methyl 2-[(4-azanyl-1,3-benzothiazol-5-yl)sulfanyl]ethanoate

Systemtic Name: methyl 2-[(4-azanyl-1,3-benzothiazol-5-yl)sulfanyl]ethanoate Openeye Name: methyl 2-[(4-amino-1,3-benzothiazol-5-yl)sulfanyl]acetate CAS Name: 2-[(4-amino-1,3-benzothiazol-5-yl)thio]acetic acid methyl ester IUPAC Name: methyl 2-[(4-amino-1,3-benzothiazol-5-yl)sulfanyl]acetate Traditional Name: 2-[(4-amino-1,3-benzothiazol-5-yl)thio]acetic acid methyl ester Formula: C10H10N2O2S2 MolecularWeight: 254.3286

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=C(C2=C(C=C1)SC=N2)N

Isomeric SMILES

COC(=O)CSC1=C(C2=C(C=C1)SC=N2)N

InChI

InChI=1S/C10H10N2O2S2/c1-14-8(13)4-15-6-2-3-7-10(9(6)11)12-5-16-7/h2-3,5H,4,11H2,1H3