methyl 2-[(3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]imidazo[1,2-a]pyridine-8-carboxylate

Systemtic Name: methyl 2-[(3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]imidazo[1,2-a]pyridine-8-carboxylate Openeye Name: methyl 2-[(3-cyclohexyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]imidazo[1,2-a]pyridine-8-carboxylate CAS Name: 2-[[(3-cyclohexyl-4-oxo-2-quinazolinyl)thio]methyl]-8-imidazo[1,2-a]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanylmethyl]imidazo[1,2-a]pyridine-8-carboxylate Traditional Name: 2-[[(3-cyclohexyl-4-keto-quinazolin-2-yl)thio]methyl]imidazo[1,2-a]pyridine-8-carboxylic acid methyl ester Formula: C24H24N4O3S MolecularWeight: 448.53736

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CN2C1=NC(=C2)CSC3=NC4=CC=CC=C4C(=O)N3C5CCCCC5

Isomeric SMILES

COC(=O)C1=CC=CN2C1=NC(=C2)CSC3=NC4=CC=CC=C4C(=O)N3C5CCCCC5

InChI

InChI=1S/C24H24N4O3S/c1-31-23(30)19-11-7-13-27-14-16(25-21(19)27)15-32-24-26-20-12-6-5-10-18(20)22(29)28(24)17-8-3-2-4-9-17/h5-7,10-14,17H,2-4,8-9,15H2,1H3