methyl 2-[(6-azanyl-1,3-benzothiazol-2-yl)sulfanyl]ethanoate

Systemtic Name: methyl 2-[(6-azanyl-1,3-benzothiazol-2-yl)sulfanyl]ethanoate Openeye Name: methyl 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]acetate CAS Name: 2-[(6-amino-1,3-benzothiazol-2-yl)thio]acetic acid methyl ester IUPAC Name: methyl 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]acetate Traditional Name: 2-[(6-amino-1,3-benzothiazol-2-yl)thio]acetic acid methyl ester Formula: C10H10N2O2S2 MolecularWeight: 254.3286

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC2=C(S1)C=C(C=C2)N

Isomeric SMILES

COC(=O)CSC1=NC2=C(S1)C=C(C=C2)N

InChI

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