3-(butanoylamino)-N-[(4-methylphenyl)methyl]-4-(4-methylphenyl)sulfonyl-benzamide

Systemtic Name: 3-(butanoylamino)-N-[(4-methylphenyl)methyl]-4-(4-methylphenyl)sulfonyl-benzamide Openeye Name: 3-(butanoylamino)-N-(p-tolylmethyl)-4-(p-tolylsulfonyl)benzamide CAS Name: N-[(4-methylphenyl)methyl]-4-(4-methylphenyl)sulfonyl-3-(1-oxobutylamino)benzamide IUPAC Name: 3-(butanoylamino)-N-[(4-methylphenyl)methyl]-4-(4-methylphenyl)sulfonylbenzamide Traditional Name: 3-butyramido-N-(4-methylbenzyl)-4-tosyl-benzamide Formula: C26H28N2O4S MolecularWeight: 464.57652

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C=CC(=C1)C(=O)NCC2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCC(=O)NC1=C(C=CC(=C1)C(=O)NCC2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H28N2O4S/c1-4-5-25(29)28-23-16-21(26(30)27-17-20-10-6-18(2)7-11-20)12-15-24(23)33(31,32)22-13-8-19(3)9-14-22/h6-16H,4-5,17H2,1-3H3,(H,27,30)(H,28,29)