2-[2-[(4-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]-N-phenethyl-benzamide

Systemtic Name: 2-[2-[(4-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]-N-phenethyl-benzamide Openeye Name: 2-[[2-[4-methoxy-N-(p-tolylsulfonyl)anilino]acetyl]amino]-N-phenethyl-benzamide CAS Name: 2-[[2-(4-methoxy-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[[2-(4-methoxy-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]-N-phenethylbenzamide Traditional Name: 2-[[2-(4-methoxy-N-tosyl-anilino)acetyl]amino]-N-phenethyl-benzamide Formula: C31H31N3O5S MolecularWeight: 557.65994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C31H31N3O5S/c1-23-12-18-27(19-13-23)40(37,38)34(25-14-16-26(39-2)17-15-25)22-30(35)33-29-11-7-6-10-28(29)31(36)32-21-20-24-8-4-3-5-9-24/h3-19H,20-22H2,1-2H3,(H,32,36)(H,33,35)