methyl 2-(2-cyanoacetamido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxylate

CAS: 560080-29-7

Formula: C14H16N2O3S

SMILES: COC(=O)C1=C(NC(=O)CC#N)SC2=C1CCCCC2

IUPAC: methyl 2-(2-cyanoacetamido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxylate

InChI: InChI=1S/C14H16N2O3S/c1-19-14(18)12-9-5-3-2-4-6-10(9)20-13(12)16-11(17)7-8-15/h2-7H2,1H3,(H,16,17)

Composition: C (57.52%), H (5.52%), N (9.58%), O (16.42%), S (10.97%)

Molar Mass: 292.35

Atom Count: 36

Heavy Atom Count: 20