methyl 2-[2-(4-oxidanylidene-3-pyridin-3-yl-quinazolin-2-yl)sulfanylethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(4-oxidanylidene-3-pyridin-3-yl-quinazolin-2-yl)sulfanylethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[4-oxo-3-(3-pyridyl)quinazolin-2-yl]sulfanylacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-[[4-oxo-3-(3-pyridinyl)-2-quinazolinyl]thio]ethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(4-oxo-3-pyridin-3-ylquinazolin-2-yl)sulfanylacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[2-[[4-keto-3-(3-pyridyl)quinazolin-2-yl]thio]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C24H20N4O4S2 MolecularWeight: 492.57

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCC2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CN=CC=C5

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCC2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CN=CC=C5

InChI

InChI=1S/C24H20N4O4S2/c1-32-23(31)20-16-8-4-10-18(16)34-21(20)27-19(29)13-33-24-26-17-9-3-2-7-15(17)22(30)28(24)14-6-5-11-25-12-14/h2-3,5-7,9,11-12H,4,8,10,13H2,1H3,(H,27,29)