N-butan-2-yl-2-[2-[(4-ethylphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzamide

Systemtic Name: N-butan-2-yl-2-[2-[(4-ethylphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzamide Openeye Name: 2-[[2-[4-ethyl-N-(p-tolylsulfonyl)anilino]acetyl]amino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-[[2-(4-ethyl-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]amino]benzamide IUPAC Name: N-butan-2-yl-2-[[2-(4-ethyl-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]benzamide Traditional Name: 2-[[2-(4-ethyl-N-tosyl-anilino)acetyl]amino]-N-sec-butyl-benzamide Formula: C28H33N3O4S MolecularWeight: 507.64432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)NC(C)CC)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)NC(C)CC)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C28H33N3O4S/c1-5-21(4)29-28(33)25-9-7-8-10-26(25)30-27(32)19-31(23-15-13-22(6-2)14-16-23)36(34,35)24-17-11-20(3)12-18-24/h7-18,21H,5-6,19H2,1-4H3,(H,29,33)(H,30,32)