N-[(2-ethoxyphenyl)methyl]-3-[(4-methylphenyl)sulfonylamino]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[(2-ethoxyphenyl)methyl]-3-[(4-methylphenyl)sulfonylamino]-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[(2-ethoxyphenyl)methyl]-3-(p-tolylsulfonylamino)-4-pyrrolidin-1-yl-benzamide CAS Name: N-[(2-ethoxyphenyl)methyl]-3-[(4-methylphenyl)sulfonylamino]-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[(2-ethoxyphenyl)methyl]-3-[(4-methylphenyl)sulfonylamino]-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(2-ethoxybenzyl)-4-pyrrolidino-3-(tosylamino)benzamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CNC(=O)C2=CC(=C(C=C2)N3CCCC3)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=CC=C1CNC(=O)C2=CC(=C(C=C2)N3CCCC3)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H31N3O4S/c1-3-34-26-9-5-4-8-22(26)19-28-27(31)21-12-15-25(30-16-6-7-17-30)24(18-21)29-35(32,33)23-13-10-20(2)11-14-23/h4-5,8-15,18,29H,3,6-7,16-17,19H2,1-2H3,(H,28,31)