ethyl 2-[4-azanyl-5-(1H-benzimidazol-2-yl)-2-sulfanylidene-1,3-thiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[4-azanyl-5-(1H-benzimidazol-2-yl)-2-sulfanylidene-1,3-thiazol-3-yl]ethanoate Openeye Name: ethyl 2-[4-amino-5-(1H-benzimidazol-2-yl)-2-thioxo-thiazol-3-yl]acetate CAS Name: 2-[4-amino-5-(1H-benzimidazol-2-yl)-2-sulfanylidene-3-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-amino-5-(1H-benzimidazol-2-yl)-2-sulfanylidene-1,3-thiazol-3-yl]acetate Traditional Name: 2-[4-amino-5-(1H-benzimidazol-2-yl)-2-thioxo-4-thiazolin-3-yl]acetic acid ethyl ester Formula: C14H14N4O2S2 MolecularWeight: 334.41656

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=C(SC1=S)C2=NC3=CC=CC=C3N2)N

Isomeric SMILES

CCOC(=O)CN1C(=C(SC1=S)C2=NC3=CC=CC=C3N2)N

InChI

InChI=1S/C14H14N4O2S2/c1-2-20-10(19)7-18-12(15)11(22-14(18)21)13-16-8-5-3-4-6-9(8)17-13/h3-6H,2,7,15H2,1H3,(H,16,17)