ethyl 2-[2-[(6-azanyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[(6-azanyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-[(6-amino-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[(6-amino-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(6-amino-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-[(6-amino-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl]thio]acetic acid ethyl ester Formula: C13H15N3O3S2 MolecularWeight: 325.4065

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NC1=NC2=C(S1)C=C(C=C2)N

Isomeric SMILES

CCOC(=O)CSCC(=O)NC1=NC2=C(S1)C=C(C=C2)N

InChI

InChI=1S/C13H15N3O3S2/c1-2-19-12(18)7-20-6-11(17)16-13-15-9-4-3-8(14)5-10(9)21-13/h3-5H,2,6-7,14H2,1H3,(H,15,16,17)