3-methyl-N-[4-[[2-(2-methylphenyl)ethanoylcarbamothioylamino]carbamoyl]phenyl]benzamide

Systemtic Name: 3-methyl-N-[4-[[2-(2-methylphenyl)ethanoylcarbamothioylamino]carbamoyl]phenyl]benzamide Openeye Name: 3-methyl-N-[4-[[[2-(o-tolyl)acetyl]carbamothioylamino]carbamoyl]phenyl]benzamide CAS Name: 3-methyl-N-[4-[[[[[2-(2-methylphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]benzamide IUPAC Name: 3-methyl-N-[4-[[[2-(2-methylphenyl)acetyl]carbamothioylamino]carbamoyl]phenyl]benzamide Traditional Name: 3-methyl-N-[4-[[[2-(o-tolyl)acetyl]thiocarbamoylamino]carbamoyl]phenyl]benzamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)CC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)CC3=CC=CC=C3C

InChI

InChI=1S/C25H24N4O3S/c1-16-6-5-9-20(14-16)23(31)26-21-12-10-18(11-13-21)24(32)28-29-25(33)27-22(30)15-19-8-4-3-7-17(19)2/h3-14H,15H2,1-2H3,(H,26,31)(H,28,32)(H2,27,29,30,33)