N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[(4,7-dimethyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-phenylacetamide Traditional Name: N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-phenyl-acetamide Formula: C18H17N3OS2 MolecularWeight: 355.47708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)NC(=S)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)NC(=S)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H17N3OS2/c1-11-8-9-12(2)16-15(11)20-18(24-16)21-17(23)19-14(22)10-13-6-4-3-5-7-13/h3-9H,10H2,1-2H3,(H2,19,20,21,22,23)