2-(4-chlorophenyl)-N-[[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-chlorophenyl)-N-[[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenyl)-N-[[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]acetamide CAS Name: 2-(4-chlorophenyl)-N-[[[2-(4-methoxyphenyl)-6-methyl-5-benzotriazolyl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenyl)-N-[[2-(4-methoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]acetamide Traditional Name: 2-(4-chlorophenyl)-N-[[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]thiocarbamoyl]acetamide Formula: C23H20ClN5O2S MolecularWeight: 465.9552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)CC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)CC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H20ClN5O2S/c1-14-11-20-21(28-29(27-20)17-7-9-18(31-2)10-8-17)13-19(14)25-23(32)26-22(30)12-15-3-5-16(24)6-4-15/h3-11,13H,12H2,1-2H3,(H2,25,26,30,32)