ethyl 2-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

CAS: 85716-87-6

Formula: C12H13NO2S2

SMILES: CCOC(=O)C1=C(SC2=C1CCCC2)N=C=S

IUPAC: ethyl 2-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

InChI: InChI=1S/C12H13NO2S2/c1-2-15-12(14)10-8-5-3-4-6-9(8)17-11(10)13-7-16/h2-6H2,1H3

Composition: C (53.91%), H (4.90%), N (5.24%), O (11.97%), S (23.98%)

Molar Mass: 267.36

Atom Count: 30

Heavy Atom Count: 17