N-[2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]phenyl]-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[2-(homoveratrylcarbamoyl)phenyl]-1-(3-phenylpropylsulfonyl)isonipecotamide Formula: C32H39N3O6S MolecularWeight: 593.73356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)CCCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)CCCC4=CC=CC=C4)OC

InChI

InChI=1S/C32H39N3O6S/c1-40-29-15-14-25(23-30(29)41-2)16-19-33-32(37)27-12-6-7-13-28(27)34-31(36)26-17-20-35(21-18-26)42(38,39)22-8-11-24-9-4-3-5-10-24/h3-7,9-10,12-15,23,26H,8,11,16-22H2,1-2H3,(H,33,37)(H,34,36)