N-[(4,6-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-4-phenyl-benzamide

Systemtic Name: N-[(4,6-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-4-phenyl-benzamide Openeye Name: N-[(4,6-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-4-phenyl-benzamide CAS Name: N-[[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-4-phenylbenzamide IUPAC Name: N-[(4,6-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-4-phenylbenzamide Traditional Name: N-[(4,6-dimethyl-1,3-benzothiazol-2-yl)thiocarbamoyl]-4-phenyl-benzamide Formula: C23H19N3OS2 MolecularWeight: 417.54646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=S)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=S)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C23H19N3OS2/c1-14-12-15(2)20-19(13-14)29-23(24-20)26-22(28)25-21(27)18-10-8-17(9-11-18)16-6-4-3-5-7-16/h3-13H,1-2H3,(H2,24,25,26,27,28)