2-[2-[(3-chlorophenyl)-methylsulfonyl-amino]butanoylamino]-N-propan-2-yl-benzamide

Systemtic Name: 2-[2-[(3-chlorophenyl)-methylsulfonyl-amino]butanoylamino]-N-propan-2-yl-benzamide Openeye Name: 2-[2-(3-chloro-N-methylsulfonyl-anilino)butanoylamino]-N-isopropyl-benzamide CAS Name: 2-[[2-(3-chloro-N-methylsulfonylanilino)-1-oxobutyl]amino]-N-propan-2-ylbenzamide IUPAC Name: 2-[2-(3-chloro-N-methylsulfonylanilino)butanoylamino]-N-propan-2-ylbenzamide Traditional Name: 2-[2-(3-chloro-N-mesyl-anilino)butanoylamino]-N-isopropyl-benzamide Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN3O4S/c1-5-19(25(30(4,28)29)16-10-8-9-15(22)13-16)21(27)24-18-12-7-6-11-17(18)20(26)23-14(2)3/h6-14,19H,5H2,1-4H3,(H,23,26)(H,24,27)