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

Systemtic Name: diethyl 5-azanyl-3-[[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-amino-3-[(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]methyl]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-amino-3-[[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[(3-isobutyl-4-keto-quinazolin-2-yl)thio]methyl]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C23H27N3O5S2 MolecularWeight: 489.60758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1CSC2=NC3=CC=CC=C3C(=O)N2CC(C)C)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1CSC2=NC3=CC=CC=C3C(=O)N2CC(C)C)C(=O)OCC)N

InChI

InChI=1S/C23H27N3O5S2/c1-5-30-21(28)17-15(18(33-19(17)24)22(29)31-6-2)12-32-23-25-16-10-8-7-9-14(16)20(27)26(23)11-13(3)4/h7-10,13H,5-6,11-12,24H2,1-4H3