methyl 2-[(4-methylphenyl)carbonylcarbamothioylamino]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[(4-methylphenyl)carbonylcarbamothioylamino]-2-phenyl-ethanoate Openeye Name: methyl 2-[(4-methylbenzoyl)carbamothioylamino]-2-phenyl-acetate CAS Name: 2-[[[[(4-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[(4-methylbenzoyl)carbamothioylamino]-2-phenylacetate Traditional Name: 2-phenyl-2-(p-toluoylthiocarbamoylamino)acetic acid methyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)NC(C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)NC(C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C18H18N2O3S/c1-12-8-10-14(11-9-12)16(21)20-18(24)19-15(17(22)23-2)13-6-4-3-5-7-13/h3-11,15H,1-2H3,(H2,19,20,21,24)