methyl 3-chloranyl-6-isothiocyanato-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-chloranyl-6-isothiocyanato-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-chloro-6-isothiocyanato-benzothiophene-2-carboxylate CAS Name: 3-chloro-6-isothiocyanato-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-chloro-6-isothiocyanato-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-isothiocyanato-benzothiophene-2-carboxylic acid methyl ester Formula: C11H6ClNO2S2 MolecularWeight: 283.75384

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(S1)C=C(C=C2)N=C=S)Cl

Isomeric SMILES

COC(=O)C1=C(C2=C(S1)C=C(C=C2)N=C=S)Cl

InChI

InChI=1S/C11H6ClNO2S2/c1-15-11(14)10-9(12)7-3-2-6(13-5-16)4-8(7)17-10/h2-4H,1H3