N-ethyl-3-[2-(2-methylphenyl)ethanoylcarbamothioylamino]-N-phenyl-benzamide

Systemtic Name: N-ethyl-3-[2-(2-methylphenyl)ethanoylcarbamothioylamino]-N-phenyl-benzamide Openeye Name: N-ethyl-3-[[2-(o-tolyl)acetyl]carbamothioylamino]-N-phenyl-benzamide CAS Name: N-ethyl-3-[[[[2-(2-methylphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: N-ethyl-3-[[2-(2-methylphenyl)acetyl]carbamothioylamino]-N-phenylbenzamide Traditional Name: N-ethyl-3-[[2-(o-tolyl)acetyl]thiocarbamoylamino]-N-phenyl-benzamide Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)CC3=CC=CC=C3C

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)CC3=CC=CC=C3C

InChI

InChI=1S/C25H25N3O2S/c1-3-28(22-14-5-4-6-15-22)24(30)20-12-9-13-21(16-20)26-25(31)27-23(29)17-19-11-8-7-10-18(19)2/h4-16H,3,17H2,1-2H3,(H2,26,27,29,31)