1-(3,4-dimethylphenyl)sulfonyl-N-[1-(4-imidazol-1-ylphenyl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[1-(4-imidazol-1-ylphenyl)ethyl]piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[1-(4-imidazol-1-ylphenyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[1-[4-(1-imidazolyl)phenyl]ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[1-(4-imidazol-1-ylphenyl)ethyl]piperidine-4-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[1-(4-imidazol-1-ylphenyl)ethyl]isonipecotamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3=CC=C(C=C3)N4C=CN=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3=CC=C(C=C3)N4C=CN=C4)C

InChI

InChI=1S/C25H30N4O3S/c1-18-4-9-24(16-19(18)2)33(31,32)29-13-10-22(11-14-29)25(30)27-20(3)21-5-7-23(8-6-21)28-15-12-26-17-28/h4-9,12,15-17,20,22H,10-11,13-14H2,1-3H3,(H,27,30)