N-[3-[1-[2-(4-fluorophenyl)piperazin-1-yl]-4-methyl-cyclohexyl]phenyl]quinoxaline-2-carboxamide

Systemtic Name: N-[3-[1-[2-(4-fluorophenyl)piperazin-1-yl]-4-methyl-cyclohexyl]phenyl]quinoxaline-2-carboxamide Openeye Name: N-[3-[1-[2-(4-fluorophenyl)piperazin-1-yl]-4-methyl-cyclohexyl]phenyl]quinoxaline-2-carboxamide CAS Name: N-[3-[1-[2-(4-fluorophenyl)-1-piperazinyl]-4-methylcyclohexyl]phenyl]-2-quinoxalinecarboxamide IUPAC Name: N-[3-[1-[2-(4-fluorophenyl)piperazin-1-yl]-4-methylcyclohexyl]phenyl]quinoxaline-2-carboxamide Traditional Name: N-[3-[1-[2-(4-fluorophenyl)piperazino]-4-methyl-cyclohexyl]phenyl]quinoxaline-2-carboxamide Formula: C32H34FN5O MolecularWeight: 523.643663

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C2=CC(=CC=C2)NC(=O)C3=NC4=CC=CC=C4N=C3)N5CCNCC5C6=CC=C(C=C6)F

Isomeric SMILES

CC1CCC(CC1)(C2=CC(=CC=C2)NC(=O)C3=NC4=CC=CC=C4N=C3)N5CCNCC5C6=CC=C(C=C6)F

InChI

InChI=1S/C32H34FN5O/c1-22-13-15-32(16-14-22,38-18-17-34-21-30(38)23-9-11-25(33)12-10-23)24-5-4-6-26(19-24)36-31(39)29-20-35-27-7-2-3-8-28(27)37-29/h2-12,19-20,22,30,34H,13-18,21H2,1H3,(H,36,39)