methyl 3-(5-aminocarbonyl-4-azanyl-2-sulfanylidene-1,3-thiazol-3-yl)-4-methyl-benzoate

Systemtic Name: methyl 3-(5-aminocarbonyl-4-azanyl-2-sulfanylidene-1,3-thiazol-3-yl)-4-methyl-benzoate Openeye Name: methyl 3-(4-amino-5-carbamoyl-2-thioxo-thiazol-3-yl)-4-methyl-benzoate CAS Name: 3-(4-amino-5-carbamoyl-2-sulfanylidene-3-thiazolyl)-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-(4-amino-5-carbamoyl-2-sulfanylidene-1,3-thiazol-3-yl)-4-methylbenzoate Traditional Name: 3-(4-amino-5-carbamoyl-2-thioxo-4-thiazolin-3-yl)-4-methyl-benzoic acid methyl ester Formula: C13H13N3O3S2 MolecularWeight: 323.39062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)N2C(=C(SC2=S)C(=O)N)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)N2C(=C(SC2=S)C(=O)N)N

InChI

InChI=1S/C13H13N3O3S2/c1-6-3-4-7(12(18)19-2)5-8(6)16-10(14)9(11(15)17)21-13(16)20/h3-5H,14H2,1-2H3,(H2,15,17)