[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-1-pyridin-3-yl-ethyl] 4-methylthieno[3,2-b]pyrrole-5-carboxylate

Systemtic Name: [2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-1-pyridin-3-yl-ethyl] 4-methylthieno[3,2-b]pyrrole-5-carboxylate Openeye Name: [2-[(4-methoxyphenyl)methylamino]-2-oxo-1-(3-pyridyl)ethyl] 4-methylthieno[3,2-b]pyrrole-5-carboxylate CAS Name: 4-methyl-5-thieno[3,2-b]pyrrolecarboxylic acid [2-[(4-methoxyphenyl)methylamino]-2-oxo-1-(3-pyridinyl)ethyl] ester IUPAC Name: [2-[(4-methoxyphenyl)methylamino]-2-oxo-1-pyridin-3-ylethyl] 4-methylthieno[3,2-b]pyrrole-5-carboxylate Traditional Name: 4-methylthieno[3,2-b]pyrrole-5-carboxylic acid [2-keto-2-(p-anisylamino)-1-(3-pyridyl)ethyl] ester Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C1C(=O)OC(C3=CN=CC=C3)C(=O)NCC4=CC=C(C=C4)OC)SC=C2

Isomeric SMILES

CN1C2=C(C=C1C(=O)OC(C3=CN=CC=C3)C(=O)NCC4=CC=C(C=C4)OC)SC=C2

InChI

InChI=1S/C23H21N3O4S/c1-26-18-9-11-31-20(18)12-19(26)23(28)30-21(16-4-3-10-24-14-16)22(27)25-13-15-5-7-17(29-2)8-6-15/h3-12,14,21H,13H2,1-2H3,(H,25,27)