N-[(4-ethoxyphenyl)-phenyl-methyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-ethoxyphenyl)-phenyl-methyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-ethoxyphenyl)-phenyl-methyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(4-ethoxyphenyl)-phenylmethyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[(4-ethoxyphenyl)-phenylmethyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[phenyl(p-phenetyl)methyl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C26H29N3O4S/c1-2-33-23-12-10-21(11-13-23)25(20-7-4-3-5-8-20)28-26(30)22-14-17-29(18-15-22)34(31,32)24-9-6-16-27-19-24/h3-13,16,19,22,25H,2,14-15,17-18H2,1H3,(H,28,30)