N-butan-2-yl-4-(4-methylphenyl)sulfonyl-3-(propanoylamino)benzamide

Systemtic Name: N-butan-2-yl-4-(4-methylphenyl)sulfonyl-3-(propanoylamino)benzamide Openeye Name: 3-(propanoylamino)-4-(p-tolylsulfonyl)-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-4-(4-methylphenyl)sulfonyl-3-(1-oxopropylamino)benzamide IUPAC Name: N-butan-2-yl-4-(4-methylphenyl)sulfonyl-3-(propanoylamino)benzamide Traditional Name: 3-propionamido-N-sec-butyl-4-tosyl-benzamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C)NC(=O)CC

Isomeric SMILES

CCC(C)NC(=O)C1=CC(=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C)NC(=O)CC

InChI

InChI=1S/C21H26N2O4S/c1-5-15(4)22-21(25)16-9-12-19(18(13-16)23-20(24)6-2)28(26,27)17-10-7-14(3)8-11-17/h7-13,15H,5-6H2,1-4H3,(H,22,25)(H,23,24)