(3S)-1-(4-fluorophenyl)carbonyl-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-fluorophenyl)carbonyl-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(4-fluorobenzoyl)-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]piperidine-3-carboxamide CAS Name: (3S)-1-[(4-fluorophenyl)-oxomethyl]-N-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-fluorobenzoyl)-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(4-fluorobenzoyl)-N-[4-(4-methylpiperazino)sulfonylphenyl]nipecotamide Formula: C24H29FN4O4S MolecularWeight: 488.574863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCCN(C3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@H]3CCCN(C3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H29FN4O4S/c1-27-13-15-29(16-14-27)34(32,33)22-10-8-21(9-11-22)26-23(30)19-3-2-12-28(17-19)24(31)18-4-6-20(25)7-5-18/h4-11,19H,2-3,12-17H2,1H3,(H,26,30)/t19-/m0/s1