methyl 4-azanyl-3-[(2-methylphenyl)carbamoylamino]-2-sulfanylidene-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 4-azanyl-3-[(2-methylphenyl)carbamoylamino]-2-sulfanylidene-1,3-thiazole-5-carboxylate Openeye Name: methyl 4-amino-3-(o-tolylcarbamoylamino)-2-thioxo-thiazole-5-carboxylate CAS Name: 4-amino-3-[[(2-methylanilino)-oxomethyl]amino]-2-sulfanylidene-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-amino-3-[(2-methylphenyl)carbamoylamino]-2-sulfanylidene-1,3-thiazole-5-carboxylate Traditional Name: 4-amino-3-(o-tolylcarbamoylamino)-2-thioxo-4-thiazoline-5-carboxylic acid methyl ester Formula: C13H14N4O3S2 MolecularWeight: 338.40526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NN2C(=C(SC2=S)C(=O)OC)N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NN2C(=C(SC2=S)C(=O)OC)N

InChI

InChI=1S/C13H14N4O3S2/c1-7-5-3-4-6-8(7)15-12(19)16-17-10(14)9(11(18)20-2)22-13(17)21/h3-6H,14H2,1-2H3,(H2,15,16,19)