2-[[4-[(4-methylphenyl)methyl-methylsulfonyl-amino]phenyl]carbonylamino]-N-prop-2-enyl-benzamide

Systemtic Name: 2-[[4-[(4-methylphenyl)methyl-methylsulfonyl-amino]phenyl]carbonylamino]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-2-[[4-[methylsulfonyl(p-tolylmethyl)amino]benzoyl]amino]benzamide CAS Name: 2-[[[4-[(4-methylphenyl)methyl-methylsulfonylamino]phenyl]-oxomethyl]amino]-N-prop-2-enylbenzamide IUPAC Name: 2-[[4-[(4-methylphenyl)methyl-methylsulfonylamino]benzoyl]amino]-N-prop-2-enylbenzamide Traditional Name: N-allyl-2-[[4-[mesyl-(4-methylbenzyl)amino]benzoyl]amino]benzamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NCC=C)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NCC=C)S(=O)(=O)C

InChI

InChI=1S/C26H27N3O4S/c1-4-17-27-26(31)23-7-5-6-8-24(23)28-25(30)21-13-15-22(16-14-21)29(34(3,32)33)18-20-11-9-19(2)10-12-20/h4-16H,1,17-18H2,2-3H3,(H,27,31)(H,28,30)