3-chloranyl-N-[[2-(4-dimethylaminophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxy-benzamide

Systemtic Name: 3-chloranyl-N-[[2-(4-dimethylaminophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxy-benzamide Openeye Name: 3-chloro-N-[[2-(4-dimethylaminophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxy-benzamide CAS Name: 3-chloro-N-[[[2-(4-dimethylaminophenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-chloro-N-[[2-(4-dimethylaminophenyl)benzotriazol-5-yl]carbamothioyl]-4-methoxybenzamide Traditional Name: 3-chloro-N-[[2-(4-dimethylaminophenyl)benzotriazol-5-yl]thiocarbamoyl]-4-methoxy-benzamide Formula: C23H21ClN6O2S MolecularWeight: 480.96984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CN(C)C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C23H21ClN6O2S/c1-29(2)16-6-8-17(9-7-16)30-27-19-10-5-15(13-20(19)28-30)25-23(33)26-22(31)14-4-11-21(32-3)18(24)12-14/h4-13H,1-3H3,(H2,25,26,31,33)