ethyl N-[2-cyano-5-ethanoyl-4-(4-methoxyphenyl)-6-methyl-thieno[2,3-b]pyridin-3-yl]methanimidate

Systemtic Name: ethyl N-[2-cyano-5-ethanoyl-4-(4-methoxyphenyl)-6-methyl-thieno[2,3-b]pyridin-3-yl]methanimidate Openeye Name: ethyl N-[5-acetyl-2-cyano-4-(4-methoxyphenyl)-6-methyl-thieno[2,3-b]pyridin-3-yl]methanimidate CAS Name: N-[5-acetyl-2-cyano-4-(4-methoxyphenyl)-6-methyl-3-thieno[2,3-b]pyridinyl]methanimidic acid ethyl ester IUPAC Name: ethyl N-[5-acetyl-2-cyano-4-(4-methoxyphenyl)-6-methylthieno[2,3-b]pyridin-3-yl]methanimidate Traditional Name: N-[5-acetyl-2-cyano-4-(4-methoxyphenyl)-6-methyl-thieno[2,3-b]pyridin-3-yl]formimidic acid ethyl ester Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=NC1=C(SC2=NC(=C(C(=C12)C3=CC=C(C=C3)OC)C(=O)C)C)C#N

Isomeric SMILES

CCOC=NC1=C(SC2=NC(=C(C(=C12)C3=CC=C(C=C3)OC)C(=O)C)C)C#N

InChI

InChI=1S/C21H19N3O3S/c1-5-27-11-23-20-16(10-22)28-21-19(20)18(17(13(3)25)12(2)24-21)14-6-8-15(26-4)9-7-14/h6-9,11H,5H2,1-4H3