N-(3-methoxyphenyl)-3-(2-methylbutylamino)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-methoxyphenyl)-3-(2-methylbutylamino)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-methoxyphenyl)-3-(2-methylbutylamino)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(3-methoxyphenyl)-3-(2-methylbutylamino)-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(3-methoxyphenyl)-3-(2-methylbutylamino)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(3-methoxyphenyl)-3-(2-methylbutylamino)-5-pyrrolidinosulfonyl-benzamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNC1=CC(=CC(=C1)C(=O)NC2=CC(=CC=C2)OC)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCC(C)CNC1=CC(=CC(=C1)C(=O)NC2=CC(=CC=C2)OC)S(=O)(=O)N3CCCC3

InChI

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