ethyl 4-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]-3-methyl-6-oxidanylidene-7H-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 4-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]-3-methyl-6-oxidanylidene-7H-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 4-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]-3-methyl-6-oxo-7H-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 4-[[[1-(3-methoxyphenyl)-2-imidazolyl]thio]methyl]-3-methyl-6-oxo-7H-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]-3-methyl-6-oxo-7H-thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 6-keto-4-[[[1-(3-methoxyphenyl)imidazol-2-yl]thio]methyl]-3-methyl-7H-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C22H21N3O4S2 MolecularWeight: 455.54984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)NC(=O)C=C2CSC3=NC=CN3C4=CC(=CC=C4)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)NC(=O)C=C2CSC3=NC=CN3C4=CC(=CC=C4)OC)C

InChI

InChI=1S/C22H21N3O4S2/c1-4-29-21(27)19-13(2)18-14(10-17(26)24-20(18)31-19)12-30-22-23-8-9-25(22)15-6-5-7-16(11-15)28-3/h5-11H,4,12H2,1-3H3,(H,24,26)