methyl 2-[(3-tert-butyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: methyl 2-[(3-tert-butyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 2-[(3-tert-butyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-[(3-tert-butyl-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[(3-tert-butyl-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 2-[(3-tert-butyl-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CNC2=C(C3=C(S2)CN(CC3)C)C(=O)OC)C(=O)C=C1

Isomeric SMILES

CC(C)(C)C1=CC(=CNC2=C(C3=C(S2)CN(CC3)C)C(=O)OC)C(=O)C=C1

InChI

InChI=1S/C21H26N2O3S/c1-21(2,3)14-6-7-16(24)13(10-14)11-22-19-18(20(25)26-5)15-8-9-23(4)12-17(15)27-19/h6-7,10-11,22H,8-9,12H2,1-5H3