prop-1-en-2-yl (2S)-7-chloranyl-2-methyl-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylate

Systemtic Name: prop-1-en-2-yl (2S)-7-chloranyl-2-methyl-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylate Openeye Name: isopropenyl (2S)-7-chloro-2-methyl-3-thioxo-2,4-dihydroquinoxaline-1-carboxylate CAS Name: (2S)-7-chloro-2-methyl-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylic acid 1-methylethenyl ester IUPAC Name: prop-1-en-2-yl (2S)-7-chloro-2-methyl-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylate Traditional Name: (2S)-7-chloro-2-methyl-3-thioxo-2,4-dihydroquinoxaline-1-carboxylic acid isopropenyl ester Formula: C13H13ClN2O2S MolecularWeight: 296.77252

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=S)NC2=C(N1C(=O)OC(=C)C)C=C(C=C2)Cl

Isomeric SMILES

C[C@H]1C(=S)NC2=C(N1C(=O)OC(=C)C)C=C(C=C2)Cl

InChI

InChI=1S/C13H13ClN2O2S/c1-7(2)18-13(17)16-8(3)12(19)15-10-5-4-9(14)6-11(10)16/h4-6,8H,1H2,2-3H3,(H,15,19)/t8-/m0/s1