4-(3,4-dimethylphenyl)sulfonyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperazine-1-carboxamide

Systemtic Name: 4-(3,4-dimethylphenyl)sulfonyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperazine-1-carboxamide Openeye Name: 4-(3,4-dimethylphenyl)sulfonyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperazine-1-carboxamide CAS Name: 4-(3,4-dimethylphenyl)sulfonyl-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]-1-piperazinecarboxamide IUPAC Name: 4-(3,4-dimethylphenyl)sulfonyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]piperazine-1-carboxamide Traditional Name: 4-(3,4-dimethylphenyl)sulfonyl-N-[2-(pyrrolidinomethyl)benzyl]piperazine-1-carboxamide Formula: C25H34N4O3S MolecularWeight: 470.62746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC=CC=C3CN4CCCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC=CC=C3CN4CCCC4)C

InChI

InChI=1S/C25H34N4O3S/c1-20-9-10-24(17-21(20)2)33(31,32)29-15-13-28(14-16-29)25(30)26-18-22-7-3-4-8-23(22)19-27-11-5-6-12-27/h3-4,7-10,17H,5-6,11-16,18-19H2,1-2H3,(H,26,30)