2-[2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]butanoylamino]-N-propan-2-yl-benzamide

Systemtic Name: 2-[2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]butanoylamino]-N-propan-2-yl-benzamide Openeye Name: 2-[2-(3,4-dimethyl-N-methylsulfonyl-anilino)butanoylamino]-N-isopropyl-benzamide CAS Name: 2-[[2-(3,4-dimethyl-N-methylsulfonylanilino)-1-oxobutyl]amino]-N-propan-2-ylbenzamide IUPAC Name: 2-[2-(3,4-dimethyl-N-methylsulfonylanilino)butanoylamino]-N-propan-2-ylbenzamide Traditional Name: N-isopropyl-2-[2-(N-mesyl-3,4-dimethyl-anilino)butanoylamino]benzamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O4S/c1-7-21(26(31(6,29)30)18-13-12-16(4)17(5)14-18)23(28)25-20-11-9-8-10-19(20)22(27)24-15(2)3/h8-15,21H,7H2,1-6H3,(H,24,27)(H,25,28)