RNU
~{N}-(5-methyl-2,3-dihydro-1,3-thiazol-2-yl)-3-(5-methylfuran-2-yl)carbonyl-1,3-thiazolidine-4-carboxamide
Created: | 2022-12-05 |
Last modified: | 2023-09-13 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 39 |
Chiral Atom Count | 0 |
Bond Count | 41 |
Aromatic Bond Count | 5 |
Chemical Component Summary | |
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Name | ~{N}-(5-methyl-2,3-dihydro-1,3-thiazol-2-yl)-3-(5-methylfuran-2-yl)carbonyl-1,3-thiazolidine-4-carboxamide |
Systematic Name (OpenEye OEToolkits) | ~{N}-(5-methyl-2,3-dihydro-1,3-thiazol-2-yl)-3-(5-methylfuran-2-yl)carbonyl-1,3-thiazolidine-4-carboxamide |
Formula | C14 H17 N3 O3 S2 |
Molecular Weight | 339.433 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | Cc1oc(cc1)C(=O)N2CSC[CH]2C(=O)N[CH]3NC=C(C)S3 |
SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1ccc(o1)C(=O)N2CSCC2C(=O)NC3NC=C(S3)C |
Canonical SMILES | CACTVS | 3.385 | Cc1oc(cc1)C(=O)N2CSC[C@@H]2C(=O)N[C@@H]3NC=C(C)S3 |
Canonical SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1ccc(o1)C(=O)N2CSCC2C(=O)NC3NC=C(S3)C |
InChI | InChI | 1.06 | InChI=1S/C14H17N3O3S2/c1-8-3-4-11(20-8)13(19)17-7-21-6-10(17)12(18)16-14-15-5-9(2)22-14/h3-5,10,14-15H,6-7H2,1-2H3,(H,16,18)/t10-,14+/m1/s1 |
InChIKey | InChI | 1.06 | UAKUHPRPOILDIK-YGRLFVJLSA-N |