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

Systemtic Name: 6-chloranyl-3-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-4-phenyl-1H-quinolin-2-one Openeye Name: 6-chloro-3-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-4-phenyl-1H-quinolin-2-one CAS Name: 6-chloro-3-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)thio]-4-phenyl-1H-quinolin-2-one IUPAC Name: 6-chloro-3-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-4-phenyl-1H-quinolin-2-one Traditional Name: 6-chloro-3-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)thio]-4-phenyl-carbostyril Formula: C29H25ClN4OS MolecularWeight: 513.053

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SC3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SC3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C29H25ClN4OS/c30-21-16-17-24-23(18-21)25(19-10-4-1-5-11-19)26(28(35)31-24)36-29-33-32-27(20-12-6-2-7-13-20)34(29)22-14-8-3-9-15-22/h1-2,4-7,10-13,16-18,22H,3,8-9,14-15H2,(H,31,35)