2-[(4-ethoxyphenyl)-methylsulfonyl-amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide

Systemtic Name: 2-[(4-ethoxyphenyl)-methylsulfonyl-amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide Openeye Name: 2-(4-ethoxy-N-methylsulfonyl-anilino)-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide CAS Name: 2-(4-ethoxy-N-methylsulfonylanilino)-N-[[4-(1-pyrrolidinyl)phenyl]methyl]propanamide IUPAC Name: 2-(4-ethoxy-N-methylsulfonylanilino)-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide Traditional Name: 2-(4-ethoxy-N-mesyl-anilino)-N-(4-pyrrolidinobenzyl)propionamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C(C)C(=O)NCC2=CC=C(C=C2)N3CCCC3)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N(C(C)C(=O)NCC2=CC=C(C=C2)N3CCCC3)S(=O)(=O)C

InChI

InChI=1S/C23H31N3O4S/c1-4-30-22-13-11-21(12-14-22)26(31(3,28)29)18(2)23(27)24-17-19-7-9-20(10-8-19)25-15-5-6-16-25/h7-14,18H,4-6,15-17H2,1-3H3,(H,24,27)