N-[1-[4-(cyclopropylcarbonylamino)phenyl]ethyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-[4-(cyclopropylcarbonylamino)phenyl]ethyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-[4-(cyclopropanecarbonylamino)phenyl]ethyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[1-[4-[[cyclopropyl(oxo)methyl]amino]phenyl]ethyl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-[4-(cyclopropanecarbonylamino)phenyl]ethyl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-[4-(cyclopropanecarbonylamino)phenyl]ethyl]-1-tosyl-isonipecotamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3=CC=C(C=C3)NC(=O)C4CC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3=CC=C(C=C3)NC(=O)C4CC4

InChI

InChI=1S/C25H31N3O4S/c1-17-3-11-23(12-4-17)33(31,32)28-15-13-21(14-16-28)24(29)26-18(2)19-7-9-22(10-8-19)27-25(30)20-5-6-20/h3-4,7-12,18,20-21H,5-6,13-16H2,1-2H3,(H,26,29)(H,27,30)