4-[4-(4-methoxyphenyl)piperidin-1-yl]-N-pentyl-5-(phenylmethyl)sulfonyl-2-(2-pyrrolidin-1-ylethylamino)benzamide

Systemtic Name: 4-[4-(4-methoxyphenyl)piperidin-1-yl]-N-pentyl-5-(phenylmethyl)sulfonyl-2-(2-pyrrolidin-1-ylethylamino)benzamide Openeye Name: 5-benzylsulfonyl-4-[4-(4-methoxyphenyl)-1-piperidyl]-N-pentyl-2-(2-pyrrolidin-1-ylethylamino)benzamide CAS Name: 4-[4-(4-methoxyphenyl)-1-piperidinyl]-N-pentyl-5-(phenylmethyl)sulfonyl-2-[2-(1-pyrrolidinyl)ethylamino]benzamide IUPAC Name: 5-benzylsulfonyl-4-[4-(4-methoxyphenyl)piperidin-1-yl]-N-pentyl-2-(2-pyrrolidin-1-ylethylamino)benzamide Traditional Name: N-amyl-5-benzylsulfonyl-4-[4-(4-methoxyphenyl)piperidino]-2-(2-pyrrolidinoethylamino)benzamide Formula: C37H50N4O4S MolecularWeight: 646.8823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC(=C(C=C1NCCN2CCCC2)N3CCC(CC3)C4=CC=C(C=C4)OC)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

CCCCCNC(=O)C1=CC(=C(C=C1NCCN2CCCC2)N3CCC(CC3)C4=CC=C(C=C4)OC)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C37H50N4O4S/c1-3-4-8-19-39-37(42)33-26-36(46(43,44)28-29-11-6-5-7-12-29)35(27-34(33)38-20-25-40-21-9-10-22-40)41-23-17-31(18-24-41)30-13-15-32(45-2)16-14-30/h5-7,11-16,26-27,31,38H,3-4,8-10,17-25,28H2,1-2H3,(H,39,42)