(E)-3-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-N-[1-(phenylmethyl)piperidin-4-yl]prop-2-enamide

Systemtic Name: (E)-3-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-N-[1-(phenylmethyl)piperidin-4-yl]prop-2-enamide Openeye Name: (E)-N-(1-benzyl-4-piperidyl)-3-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]prop-2-enamide CAS Name: (E)-3-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-N-[1-(phenylmethyl)-4-piperidinyl]-2-propenamide IUPAC Name: (E)-N-(1-benzylpiperidin-4-yl)-3-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-N-(1-benzyl-4-piperidyl)-3-(4-methoxy-3-piperidinosulfonyl-phenyl)acrylamide Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC2CCN(CC2)CC3=CC=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC2CCN(CC2)CC3=CC=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C27H35N3O4S/c1-34-25-12-10-22(20-26(25)35(32,33)30-16-6-3-7-17-30)11-13-27(31)28-24-14-18-29(19-15-24)21-23-8-4-2-5-9-23/h2,4-5,8-13,20,24H,3,6-7,14-19,21H2,1H3,(H,28,31)/b13-11+