ethyl 2-(3-methyl-2-sulfanylidene-1,3-benzothiazol-6-yl)ethanoate

Systemtic Name: ethyl 2-(3-methyl-2-sulfanylidene-1,3-benzothiazol-6-yl)ethanoate Openeye Name: ethyl 2-(3-methyl-2-thioxo-1,3-benzothiazol-6-yl)acetate CAS Name: 2-(3-methyl-2-sulfanylidene-1,3-benzothiazol-6-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(3-methyl-2-sulfanylidene-1,3-benzothiazol-6-yl)acetate Traditional Name: 2-(3-methyl-2-thioxo-1,3-benzothiazol-6-yl)acetic acid ethyl ester Formula: C12H13NO2S2 MolecularWeight: 267.36712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC2=C(C=C1)N(C(=S)S2)C

Isomeric SMILES

CCOC(=O)CC1=CC2=C(C=C1)N(C(=S)S2)C

InChI

InChI=1S/C12H13NO2S2/c1-3-15-11(14)7-8-4-5-9-10(6-8)17-12(16)13(9)2/h4-6H,3,7H2,1-2H3