2-[(2-ethoxyphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide

Systemtic Name: 2-[(2-ethoxyphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide Openeye Name: 2-(2-ethoxy-N-(4-methylsulfanylphenyl)sulfonyl-anilino)-N-(3-pyrrolidin-1-ylpropyl)acetamide CAS Name: 2-(2-ethoxy-N-[4-(methylthio)phenyl]sulfonylanilino)-N-[3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-(2-ethoxy-N-(4-methylsulfanylphenyl)sulfonylanilino)-N-(3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: 2-(2-ethoxy-N-[4-(methylthio)phenyl]sulfonyl-anilino)-N-(3-pyrrolidinopropyl)acetamide Formula: C24H33N3O4S2 MolecularWeight: 491.66652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N(CC(=O)NCCCN2CCCC2)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCOC1=CC=CC=C1N(CC(=O)NCCCN2CCCC2)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C24H33N3O4S2/c1-3-31-23-10-5-4-9-22(23)27(33(29,30)21-13-11-20(32-2)12-14-21)19-24(28)25-15-8-18-26-16-6-7-17-26/h4-5,9-14H,3,6-8,15-19H2,1-2H3,(H,25,28)