S-[2-[(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)amino]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)amino]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl] ester IUPAC Name: S-[2-[(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)amino]-2-keto-ethyl] ester Formula: C13H13BrN2O2S2 MolecularWeight: 373.28852

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CSC(=O)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CSC(=O)C

InChI

InChI=1S/C13H13BrN2O2S2/c1-3-16-10-5-4-9(14)6-11(10)20-13(16)15-12(18)7-19-8(2)17/h4-6H,3,7H2,1-2H3