N-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]-4-methylsulfonyl-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: N-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]-4-methylsulfonyl-N-(pyridin-3-ylmethyl)benzamide Openeye Name: N-[1-[2-(4-methoxyphenyl)ethyl]-4-piperidyl]-4-methylsulfonyl-N-(3-pyridylmethyl)benzamide CAS Name: N-[1-[2-(4-methoxyphenyl)ethyl]-4-piperidinyl]-4-methylsulfonyl-N-(3-pyridinylmethyl)benzamide IUPAC Name: N-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]-4-methylsulfonyl-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-mesyl-N-[1-[2-(4-methoxyphenyl)ethyl]-4-piperidyl]-N-(3-pyridylmethyl)benzamide Formula: C28H33N3O4S MolecularWeight: 507.64432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCN2CCC(CC2)N(CC3=CN=CC=C3)C(=O)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)CCN2CCC(CC2)N(CC3=CN=CC=C3)C(=O)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C28H33N3O4S/c1-35-26-9-5-22(6-10-26)13-17-30-18-14-25(15-19-30)31(21-23-4-3-16-29-20-23)28(32)24-7-11-27(12-8-24)36(2,33)34/h3-12,16,20,25H,13-15,17-19,21H2,1-2H3