2-[2-[(4-chlorophenyl)-methylsulfonyl-amino]butanoylamino]-N-(1-phenylethyl)benzamide

Systemtic Name: 2-[2-[(4-chlorophenyl)-methylsulfonyl-amino]butanoylamino]-N-(1-phenylethyl)benzamide Openeye Name: 2-[2-(4-chloro-N-methylsulfonyl-anilino)butanoylamino]-N-(1-phenylethyl)benzamide CAS Name: 2-[[2-(4-chloro-N-methylsulfonylanilino)-1-oxobutyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: 2-[2-(4-chloro-N-methylsulfonylanilino)butanoylamino]-N-(1-phenylethyl)benzamide Traditional Name: 2-[2-(4-chloro-N-mesyl-anilino)butanoylamino]-N-(1-phenylethyl)benzamide Formula: C26H28ClN3O4S MolecularWeight: 514.03622

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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=C(C=C3)Cl)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C26H28ClN3O4S/c1-4-24(30(35(3,33)34)21-16-14-20(27)15-17-21)26(32)29-23-13-9-8-12-22(23)25(31)28-18(2)19-10-6-5-7-11-19/h5-18,24H,4H2,1-3H3,(H,28,31)(H,29,32)