methyl 6-cyclohexyl-2-methyl-5-oxidanylidene-4-thiophen-2-yl-4,7-dihydro-1H-pyrrolo[3,4-b]pyridine-3-carboxylate

Systemtic Name: methyl 6-cyclohexyl-2-methyl-5-oxidanylidene-4-thiophen-2-yl-4,7-dihydro-1H-pyrrolo[3,4-b]pyridine-3-carboxylate Openeye Name: methyl 6-cyclohexyl-2-methyl-5-oxo-4-(2-thienyl)-4,7-dihydro-1H-pyrrolo[3,4-b]pyridine-3-carboxylate CAS Name: 6-cyclohexyl-2-methyl-5-oxo-4-thiophen-2-yl-4,7-dihydro-1H-pyrrolo[3,4-b]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-cyclohexyl-2-methyl-5-oxo-4-thiophen-2-yl-4,7-dihydro-1H-pyrrolo[3,4-b]pyridine-3-carboxylate Traditional Name: 6-cyclohexyl-5-keto-2-methyl-4-(2-thienyl)-4,7-dihydro-1H-pyrrolo[3,4-b]pyridine-3-carboxylic acid methyl ester Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CN(C2=O)C3CCCCC3)C4=CC=CS4)C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(N1)CN(C2=O)C3CCCCC3)C4=CC=CS4)C(=O)OC

InChI

InChI=1S/C20H24N2O3S/c1-12-16(20(24)25-2)18(15-9-6-10-26-15)17-14(21-12)11-22(19(17)23)13-7-4-3-5-8-13/h6,9-10,13,18,21H,3-5,7-8,11H2,1-2H3