ethyl 4-azanyl-3-(1,3-benzodioxol-5-yl)-2-sulfanylidene-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-azanyl-3-(1,3-benzodioxol-5-yl)-2-sulfanylidene-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-amino-3-(1,3-benzodioxol-5-yl)-2-thioxo-thiazole-5-carboxylate CAS Name: 4-amino-3-(1,3-benzodioxol-5-yl)-2-sulfanylidene-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-3-(1,3-benzodioxol-5-yl)-2-sulfanylidene-1,3-thiazole-5-carboxylate Traditional Name: 4-amino-3-(1,3-benzodioxol-5-yl)-2-thioxo-4-thiazoline-5-carboxylic acid ethyl ester Formula: C13H12N2O4S2 MolecularWeight: 324.37538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)S1)C2=CC3=C(C=C2)OCO3)N

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)S1)C2=CC3=C(C=C2)OCO3)N

InChI

InChI=1S/C13H12N2O4S2/c1-2-17-12(16)10-11(14)15(13(20)21-10)7-3-4-8-9(5-7)19-6-18-8/h3-5H,2,6,14H2,1H3