N-butan-2-yl-2-[2-[(2,5-dimethoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzamide

Systemtic Name: N-butan-2-yl-2-[2-[(2,5-dimethoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzamide Openeye Name: 2-[[2-[2,5-dimethoxy-N-(p-tolylsulfonyl)anilino]acetyl]amino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-[[2-(2,5-dimethoxy-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]amino]benzamide IUPAC Name: N-butan-2-yl-2-[[2-(2,5-dimethoxy-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]benzamide Traditional Name: 2-[[2-(2,5-dimethoxy-N-tosyl-anilino)acetyl]amino]-N-sec-butyl-benzamide Formula: C28H33N3O6S MolecularWeight: 539.64312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)CN(C2=C(C=CC(=C2)OC)OC)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)CN(C2=C(C=CC(=C2)OC)OC)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C28H33N3O6S/c1-6-20(3)29-28(33)23-9-7-8-10-24(23)30-27(32)18-31(25-17-21(36-4)13-16-26(25)37-5)38(34,35)22-14-11-19(2)12-15-22/h7-17,20H,6,18H2,1-5H3,(H,29,33)(H,30,32)