N-[(4,6-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-3,5-dimethyl-benzamide

Systemtic Name: N-[(4,6-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-3,5-dimethyl-benzamide Openeye Name: N-[(4,6-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-3,5-dimethyl-benzamide CAS Name: N-[[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-3,5-dimethylbenzamide IUPAC Name: N-[(4,6-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]-3,5-dimethylbenzamide Traditional Name: N-[(4,6-dimethyl-1,3-benzothiazol-2-yl)thiocarbamoyl]-3,5-dimethyl-benzamide Formula: C19H19N3OS2 MolecularWeight: 369.50366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=NC3=C(C=C(C=C3S2)C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=NC3=C(C=C(C=C3S2)C)C)C

InChI

InChI=1S/C19H19N3OS2/c1-10-5-11(2)8-14(7-10)17(23)21-18(24)22-19-20-16-13(4)6-12(3)9-15(16)25-19/h5-9H,1-4H3,(H2,20,21,22,23,24)