N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-methyl-butanamide Openeye Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-methyl-butanamide CAS Name: N-[[2-(1,3-benzothiazol-2-yl)anilino]-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-methylbutanamide Traditional Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]thiocarbamoyl]-3-methyl-butyramide Formula: C19H19N3OS2 MolecularWeight: 369.50366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC=CC=C1C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC=CC=C1C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H19N3OS2/c1-12(2)11-17(23)22-19(24)21-14-8-4-3-7-13(14)18-20-15-9-5-6-10-16(15)25-18/h3-10,12H,11H2,1-2H3,(H2,21,22,23,24)