4-(3-methylphenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-(3-methylphenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperazine-1-carboxamide Openeye Name: 4-(m-tolyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperazine-1-carboxamide CAS Name: 4-(3-methylphenyl)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(3-methylphenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperazine-1-carboxamide Traditional Name: 4-(m-tolyl)-N-(4-pyrrolidinosulfonylphenyl)piperazine-1-carboxamide Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H28N4O3S/c1-18-5-4-6-20(17-18)24-13-15-25(16-14-24)22(27)23-19-7-9-21(10-8-19)30(28,29)26-11-2-3-12-26/h4-10,17H,2-3,11-16H2,1H3,(H,23,27)