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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NCC=C)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1CN(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)23-11-7-8-12-24(23)28-25(30)20-13-15-22(16-14-20)29(34(3,32)33)18-21-10-6-5-9-19(21)2/h4-16H,1,17-18H2,2-3H3,(H,27,31)(H,28,30)