methyl 4-(4-bromophenyl)-2-(2-cyanoacetamido)thiophene-3-carboxylate

CAS: 545385-40-8

Formula: C15H11BrN2O3S

SMILES: COC(=O)C1=C(NC(=O)CC#N)SC=C1C1=CC=C(Br)C=C1

IUPAC: methyl 4-(4-bromophenyl)-2-(2-cyanoacetamido)thiophene-3-carboxylate

InChI: InChI=1S/C15H11BrN2O3S/c1-21-15(20)13-11(9-2-4-10(16)5-3-9)8-22-14(13)18-12(19)6-7-17/h2-5,8H,6H2,1H3,(H,18,19)

Composition: C (47.51%), H (2.92%), Br (21.07%), N (7.39%), O (12.66%), S (8.45%)

Molar Mass: 379.23

Atom Count: 33

Heavy Atom Count: 22