6-chloranyl-3-[[5-(3,5-dimethoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one

Systemtic Name: 6-chloranyl-3-[[5-(3,5-dimethoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one Openeye Name: 6-chloro-3-[[5-(3,5-dimethoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one CAS Name: 6-chloro-3-[[5-(3,5-dimethoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]thio]-4-phenyl-1H-quinolin-2-one IUPAC Name: 6-chloro-3-[[5-(3,5-dimethoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one Traditional Name: 6-chloro-3-[[5-(3,5-dimethoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]thio]-4-phenyl-carbostyril Formula: C33H27ClN4O3S MolecularWeight: 595.11048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C2=NN=C(N2CCC3=CC=CC=C3)SC4=C(C5=C(C=CC(=C5)Cl)NC4=O)C6=CC=CC=C6)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C2=NN=C(N2CCC3=CC=CC=C3)SC4=C(C5=C(C=CC(=C5)Cl)NC4=O)C6=CC=CC=C6)OC

InChI

InChI=1S/C33H27ClN4O3S/c1-40-25-17-23(18-26(20-25)41-2)31-36-37-33(38(31)16-15-21-9-5-3-6-10-21)42-30-29(22-11-7-4-8-12-22)27-19-24(34)13-14-28(27)35-32(30)39/h3-14,17-20H,15-16H2,1-2H3,(H,35,39)