methyl N-[[2-(2-chlorophenyl)quinolin-4-yl]carbonylcarbamothioylamino]carbamate

Systemtic Name: methyl N-[[2-(2-chlorophenyl)quinolin-4-yl]carbonylcarbamothioylamino]carbamate Openeye Name: methyl N-[[2-(2-chlorophenyl)quinoline-4-carbonyl]carbamothioylamino]carbamate CAS Name: N-[[[[[2-(2-chlorophenyl)-4-quinolinyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[[2-(2-chlorophenyl)quinoline-4-carbonyl]carbamothioylamino]carbamate Traditional Name: N-[[2-(2-chlorophenyl)quinoline-4-carbonyl]thiocarbamoylamino]carbamic acid methyl ester Formula: C19H15ClN4O3S MolecularWeight: 414.8654

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NNC(=S)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3Cl

Isomeric SMILES

COC(=O)NNC(=S)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H15ClN4O3S/c1-27-19(26)24-23-18(28)22-17(25)13-10-16(12-7-2-4-8-14(12)20)21-15-9-5-3-6-11(13)15/h2-10H,1H3,(H,24,26)(H2,22,23,25,28)