N-(3-methylbutyl)-3-[(4-methylphenyl)sulfonylamino]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(3-methylbutyl)-3-[(4-methylphenyl)sulfonylamino]-4-pyrrolidin-1-yl-benzamide Openeye Name: N-isopentyl-3-(p-tolylsulfonylamino)-4-pyrrolidin-1-yl-benzamide CAS Name: N-(3-methylbutyl)-3-[(4-methylphenyl)sulfonylamino]-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(3-methylbutyl)-3-[(4-methylphenyl)sulfonylamino]-4-pyrrolidin-1-ylbenzamide Traditional Name: N-isoamyl-4-pyrrolidino-3-(tosylamino)benzamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)NCCC(C)C)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)NCCC(C)C)N3CCCC3

InChI

InChI=1S/C23H31N3O3S/c1-17(2)12-13-24-23(27)19-8-11-22(26-14-4-5-15-26)21(16-19)25-30(28,29)20-9-6-18(3)7-10-20/h6-11,16-17,25H,4-5,12-15H2,1-3H3,(H,24,27)