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

Systemtic Name: 4-(4-chlorophenyl)-3-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-6-fluoranyl-1H-quinolin-2-one Openeye Name: 4-(4-chlorophenyl)-3-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-6-fluoro-1H-quinolin-2-one CAS Name: 4-(4-chlorophenyl)-3-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)thio]-6-fluoro-1H-quinolin-2-one IUPAC Name: 4-(4-chlorophenyl)-3-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-6-fluoro-1H-quinolin-2-one Traditional Name: 4-(4-chlorophenyl)-3-[(4-cyclohexyl-5-phenyl-1,2,4-triazol-3-yl)thio]-6-fluoro-carbostyril Formula: C29H24ClFN4OS MolecularWeight: 531.043463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H24ClFN4OS/c30-20-13-11-18(12-14-20)25-23-17-21(31)15-16-24(23)32-28(36)26(25)37-29-34-33-27(19-7-3-1-4-8-19)35(29)22-9-5-2-6-10-22/h1,3-4,7-8,11-17,22H,2,5-6,9-10H2,(H,32,36)