1-(2,4-dimethylphenyl)sulfonyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(2,4-dimethylphenyl)sulfonyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)piperidine-4-carboxamide Openeye Name: 1-(2,4-dimethylphenyl)sulfonyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)piperidine-4-carboxamide CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[3-(1-pyrrolidinyl)-2-quinoxalinyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,4-dimethylphenyl)sulfonyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)piperidine-4-carboxamide Traditional Name: 1-(2,4-dimethylphenyl)sulfonyl-N-(3-pyrrolidinoquinoxalin-2-yl)isonipecotamide Formula: C26H31N5O3S MolecularWeight: 493.62104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC4=CC=CC=C4N=C3N5CCCC5)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC4=CC=CC=C4N=C3N5CCCC5)C

InChI

InChI=1S/C26H31N5O3S/c1-18-9-10-23(19(2)17-18)35(33,34)31-15-11-20(12-16-31)26(32)29-24-25(30-13-5-6-14-30)28-22-8-4-3-7-21(22)27-24/h3-4,7-10,17,20H,5-6,11-16H2,1-2H3,(H,27,29,32)