N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-2-methyl-propanamide

Systemtic Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-2-methyl-propanamide Openeye Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-2-methyl-propanamide CAS Name: N-[[4-(1,3-benzothiazol-2-yl)anilino]-sulfanylidenemethyl]-2-methylpropanamide IUPAC Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-2-methylpropanamide Traditional Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]thiocarbamoyl]-2-methyl-propionamide Formula: C18H17N3OS2 MolecularWeight: 355.47708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(=S)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)C(=O)NC(=S)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2

InChI

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