[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(pyrrolidin-1-ylmethyl)phenyl]methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(pyrrolidin-1-ylmethyl)phenyl]methanone Openeye Name: [4-(p-tolylsulfonyl)piperazin-1-yl]-[4-(pyrrolidin-1-ylmethyl)phenyl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-[4-(1-pyrrolidinylmethyl)phenyl]methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(pyrrolidin-1-ylmethyl)phenyl]methanone Traditional Name: [4-(pyrrolidinomethyl)phenyl]-(4-tosylpiperazino)methanone Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCCC4

InChI

InChI=1S/C23H29N3O3S/c1-19-4-10-22(11-5-19)30(28,29)26-16-14-25(15-17-26)23(27)21-8-6-20(7-9-21)18-24-12-2-3-13-24/h4-11H,2-3,12-18H2,1H3