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

Systemtic Name: N-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-methyl-butanamide Openeye Name: N-[[4-(4-chlorophenyl)thiazol-2-yl]carbamothioyl]-3-methyl-butanamide CAS Name: N-[[[4-(4-chlorophenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-methylbutanamide Traditional Name: N-[[4-(4-chlorophenyl)thiazol-2-yl]thiocarbamoyl]-3-methyl-butyramide Formula: C15H16ClN3OS2 MolecularWeight: 353.89004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16ClN3OS2/c1-9(2)7-13(20)18-14(21)19-15-17-12(8-22-15)10-3-5-11(16)6-4-10/h3-6,8-9H,7H2,1-2H3,(H2,17,18,19,20,21)