N-[1-[(2-cyanophenyl)methyl]piperidin-4-yl]-4-methoxy-N-(3-methoxyphenyl)benzenesulfonamide

Systemtic Name: N-[1-[(2-cyanophenyl)methyl]piperidin-4-yl]-4-methoxy-N-(3-methoxyphenyl)benzenesulfonamide Openeye Name: N-[1-[(2-cyanophenyl)methyl]-4-piperidyl]-4-methoxy-N-(3-methoxyphenyl)benzenesulfonamide CAS Name: N-[1-[(2-cyanophenyl)methyl]-4-piperidinyl]-4-methoxy-N-(3-methoxyphenyl)benzenesulfonamide IUPAC Name: N-[1-[(2-cyanophenyl)methyl]piperidin-4-yl]-4-methoxy-N-(3-methoxyphenyl)benzenesulfonamide Traditional Name: N-[1-(2-cyanobenzyl)-4-piperidyl]-4-methoxy-N-(3-methoxyphenyl)benzenesulfonamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(C2CCN(CC2)CC3=CC=CC=C3C#N)C4=CC(=CC=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(C2CCN(CC2)CC3=CC=CC=C3C#N)C4=CC(=CC=C4)OC

InChI

InChI=1S/C27H29N3O4S/c1-33-25-10-12-27(13-11-25)35(31,32)30(24-8-5-9-26(18-24)34-2)23-14-16-29(17-15-23)20-22-7-4-3-6-21(22)19-28/h3-13,18,23H,14-17,20H2,1-2H3