2-[methylsulfonyl-(4-phenylmethoxyphenyl)amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide

Systemtic Name: 2-[methylsulfonyl-(4-phenylmethoxyphenyl)amino]-N-(3-pyrrolidin-1-ylpropyl)ethanamide Openeye Name: 2-(4-benzyloxy-N-methylsulfonyl-anilino)-N-(3-pyrrolidin-1-ylpropyl)acetamide CAS Name: 2-(N-methylsulfonyl-4-phenylmethoxyanilino)-N-[3-(1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-(N-methylsulfonyl-4-phenylmethoxyanilino)-N-(3-pyrrolidin-1-ylpropyl)acetamide Traditional Name: 2-(4-benzoxy-N-mesyl-anilino)-N-(3-pyrrolidinopropyl)acetamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCCN1CCCC1)C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCCN1CCCC1)C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O4S/c1-31(28,29)26(18-23(27)24-14-7-17-25-15-5-6-16-25)21-10-12-22(13-11-21)30-19-20-8-3-2-4-9-20/h2-4,8-13H,5-7,14-19H2,1H3,(H,24,27)