4-[[(4-ethoxyphenyl)-(4-methylphenyl)sulfonyl-amino]methyl]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-[[(4-ethoxyphenyl)-(4-methylphenyl)sulfonyl-amino]methyl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-[[4-ethoxy-N-(p-tolylsulfonyl)anilino]methyl]-N-(3-pyridylmethyl)benzamide CAS Name: 4-[(4-ethoxy-N-(4-methylphenyl)sulfonylanilino)methyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-[(4-ethoxy-N-(4-methylphenyl)sulfonylanilino)methyl]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-[(4-ethoxy-N-tosyl-anilino)methyl]-N-(3-pyridylmethyl)benzamide Formula: C29H29N3O4S MolecularWeight: 515.62326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NCC3=CN=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC2=CC=C(C=C2)C(=O)NCC3=CN=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H29N3O4S/c1-3-36-27-14-12-26(13-15-27)32(37(34,35)28-16-6-22(2)7-17-28)21-23-8-10-25(11-9-23)29(33)31-20-24-5-4-18-30-19-24/h4-19H,3,20-21H2,1-2H3,(H,31,33)