dimethyl 5-azanyl-3-[[3-(4-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[[3-(4-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[3-(4-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[[3-(4-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[3-(4-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[[4-keto-3-(4-methyl-2-pyridyl)quinazolin-2-yl]thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C23H20N4O5S2 MolecularWeight: 496.5587

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(SC(=C4C(=O)OC)N)C(=O)OC

Isomeric SMILES

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C(SC(=C4C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C23H20N4O5S2/c1-12-8-9-25-16(10-12)27-20(28)13-6-4-5-7-15(13)26-23(27)33-11-14-17(21(29)31-2)19(24)34-18(14)22(30)32-3/h4-10H,11,24H2,1-3H3