2-[2-[methylsulfonyl(phenyl)amino]butanoylamino]-N-(1-phenylethyl)benzamide

Systemtic Name: 2-[2-[methylsulfonyl(phenyl)amino]butanoylamino]-N-(1-phenylethyl)benzamide Openeye Name: 2-[2-(N-methylsulfonylanilino)butanoylamino]-N-(1-phenylethyl)benzamide CAS Name: 2-[[2-(N-methylsulfonylanilino)-1-oxobutyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: 2-[2-(N-methylsulfonylanilino)butanoylamino]-N-(1-phenylethyl)benzamide Traditional Name: 2-[2-(N-mesylanilino)butanoylamino]-N-(1-phenylethyl)benzamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)NC(C)C2=CC=CC=C2)N(C3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)NC(C)C2=CC=CC=C2)N(C3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C26H29N3O4S/c1-4-24(29(34(3,32)33)21-15-9-6-10-16-21)26(31)28-23-18-12-11-17-22(23)25(30)27-19(2)20-13-7-5-8-14-20/h5-19,24H,4H2,1-3H3,(H,27,30)(H,28,31)