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

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]acetamide CAS Name: 2-[(4-chlorophenyl)thio]-N-[[[2-(4-methoxyphenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]acetamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]thiocarbamoyl]acetamide Formula: C22H18ClN5O2S2 MolecularWeight: 483.99362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN5O2S2/c1-30-17-7-5-16(6-8-17)28-26-19-11-4-15(12-20(19)27-28)24-22(31)25-21(29)13-32-18-9-2-14(23)3-10-18/h2-12H,13H2,1H3,(H2,24,25,29,31)