1-(3,4-dimethylphenyl)sulfonyl-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]piperidine-4-carboxamide CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]piperidine-4-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[4-(4-ethylpiperazino)-2-methyl-phenyl]isonipecotamide Formula: C27H38N4O3S MolecularWeight: 498.68062

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)C)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)C)C)C

InChI

InChI=1S/C27H38N4O3S/c1-5-29-14-16-30(17-15-29)24-7-9-26(22(4)18-24)28-27(32)23-10-12-31(13-11-23)35(33,34)25-8-6-20(2)21(3)19-25/h6-9,18-19,23H,5,10-17H2,1-4H3,(H,28,32)