ethyl 6-methyl-2-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: ethyl 6-methyl-2-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: ethyl 6-methyl-2-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 6-methyl-2-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-2-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 2-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid ethyl ester Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCN(C2)C)NC=C3C(=NN(C3=O)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCN(C2)C)NC=C3C(=NN(C3=O)C4=CC=CC=C4)C

InChI

InChI=1S/C22H24N4O3S/c1-4-29-22(28)19-16-10-11-25(3)13-18(16)30-20(19)23-12-17-14(2)24-26(21(17)27)15-8-6-5-7-9-15/h5-9,12,23H,4,10-11,13H2,1-3H3