N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-methyl-butanamide Openeye Name: N-[[4-(3,4-dimethoxyphenyl)thiazol-2-yl]carbamothioyl]-3-methyl-butanamide CAS Name: N-[[[4-(3,4-dimethoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-methylbutanamide Traditional Name: N-[[4-(3,4-dimethoxyphenyl)thiazol-2-yl]thiocarbamoyl]-3-methyl-butyramide Formula: C17H21N3O3S2 MolecularWeight: 379.49694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=NC(=CS1)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=NC(=CS1)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H21N3O3S2/c1-10(2)7-15(21)19-16(24)20-17-18-12(9-25-17)11-5-6-13(22-3)14(8-11)23-4/h5-6,8-10H,7H2,1-4H3,(H2,18,19,20,21,24)