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

CAS: 588694-54-6

Formula: C11H11NO2S2

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

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

InChI: InChI=1S/C11H11NO2S2/c1-14-11(13)9-7-4-2-3-5-8(7)16-10(9)12-6-15/h2-5H2,1H3

Composition: C (52.15%), H (4.38%), N (5.53%), O (12.63%), S (25.31%)

Molar Mass: 253.33

Atom Count: 27

Heavy Atom Count: 16