methyl 2-(2-cyanoacetamido)-4H,5H,6H,7H,8H,9H-cycloocta[b]thiophene-3-carboxylate

CAS: 666728-99-0

Formula: C15H18N2O3S

SMILES: COC(=O)C1=C(NC(=O)CC#N)SC2=C1CCCCCC2

IUPAC: methyl 2-(2-cyanoacetamido)-4H,5H,6H,7H,8H,9H-cycloocta[b]thiophene-3-carboxylate

InChI: InChI=1S/C15H18N2O3S/c1-20-15(19)13-10-6-4-2-3-5-7-11(10)21-14(13)17-12(18)8-9-16/h2-8H2,1H3,(H,17,18)

Composition: C (58.80%), H (5.92%), N (9.14%), O (15.67%), S (10.46%)

Molar Mass: 306.38

Atom Count: 39

Heavy Atom Count: 21