1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]-3-pyridin-3-yl-propan-1-one

Systemtic Name: 1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]-3-pyridin-3-yl-propan-1-one Openeye Name: 1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]-3-(3-pyridyl)propan-1-one CAS Name: 1-[4-(4-propylphenyl)sulfonyl-1-piperazinyl]-3-(3-pyridinyl)-1-propanone IUPAC Name: 1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]-3-pyridin-3-ylpropan-1-one Traditional Name: 1-[4-(4-propylphenyl)sulfonylpiperazino]-3-(3-pyridyl)propan-1-one Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CN=CC=C3

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CN=CC=C3

InChI

InChI=1S/C21H27N3O3S/c1-2-4-18-6-9-20(10-7-18)28(26,27)24-15-13-23(14-16-24)21(25)11-8-19-5-3-12-22-17-19/h3,5-7,9-10,12,17H,2,4,8,11,13-16H2,1H3