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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNC2=C(C3=C(S2)CN(CC3)C)C(=O)OC(C)(C)C)C(=O)C=C1

Isomeric SMILES

CC1=CC(=CNC2=C(C3=C(S2)CN(CC3)C)C(=O)OC(C)(C)C)C(=O)C=C1

InChI

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