N-[6-[4-(2-bromophenyl)carbonylpiperazin-1-yl]pyridin-3-yl]pentane-1-sulfonamide

Systemtic Name: N-[6-[4-(2-bromophenyl)carbonylpiperazin-1-yl]pyridin-3-yl]pentane-1-sulfonamide Openeye Name: N-[6-[4-(2-bromobenzoyl)piperazin-1-yl]-3-pyridyl]pentane-1-sulfonamide CAS Name: N-[6-[4-[(2-bromophenyl)-oxomethyl]-1-piperazinyl]-3-pyridinyl]-1-pentanesulfonamide IUPAC Name: N-[6-[4-(2-bromobenzoyl)piperazin-1-yl]pyridin-3-yl]pentane-1-sulfonamide Traditional Name: N-[6-[4-(2-bromobenzoyl)piperazino]-3-pyridyl]pentane-1-sulfonamide Formula: C21H27BrN4O3S MolecularWeight: 495.43308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)NC1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3Br

Isomeric SMILES

CCCCCS(=O)(=O)NC1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C21H27BrN4O3S/c1-2-3-6-15-30(28,29)24-17-9-10-20(23-16-17)25-11-13-26(14-12-25)21(27)18-7-4-5-8-19(18)22/h4-5,7-10,16,24H,2-3,6,11-15H2,1H3