N-[[2-(3-chloranyl-4-methoxy-phenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[[2-(3-chloranyl-4-methoxy-phenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]-2,2-diphenyl-ethanamide Openeye Name: N-[[2-(3-chloro-4-methoxy-phenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]-2,2-diphenyl-acetamide CAS Name: N-[[[2-(3-chloro-4-methoxyphenyl)-6-methyl-5-benzotriazolyl]amino]-sulfanylidenemethyl]-2,2-diphenylacetamide IUPAC Name: N-[[2-(3-chloro-4-methoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]-2,2-diphenylacetamide Traditional Name: N-[[2-(3-chloro-4-methoxy-phenyl)-6-methyl-benzotriazol-5-yl]thiocarbamoyl]-2,2-diphenyl-acetamide Formula: C29H24ClN5O2S MolecularWeight: 542.05116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=C(C=C5)OC)Cl

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=C(C=C5)OC)Cl

InChI

InChI=1S/C29H24ClN5O2S/c1-18-15-24-25(34-35(33-24)21-13-14-26(37-2)22(30)16-21)17-23(18)31-29(38)32-28(36)27(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-17,27H,1-2H3,(H2,31,32,36,38)