dimethyl 5-azanyl-3-[(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[(7-chloro-3-isopropyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[(7-chloro-4-oxo-3-propan-2-yl-2-quinazolinyl)thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(7-chloro-4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[(7-chloro-3-isopropyl-4-keto-quinazolin-2-yl)thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C20H20ClN3O5S2 MolecularWeight: 481.9729

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

Isomeric SMILES

CC(C)N1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C20H20ClN3O5S2/c1-9(2)24-17(25)11-6-5-10(21)7-13(11)23-20(24)30-8-12-14(18(26)28-3)16(22)31-15(12)19(27)29-4/h5-7,9H,8,22H2,1-4H3