methyl 3-(3-methoxypropyl)-4-oxidanylidene-2-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-quinazoline-7-carboxylate

Systemtic Name: methyl 3-(3-methoxypropyl)-4-oxidanylidene-2-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-quinazoline-7-carboxylate Openeye Name: methyl 3-(3-methoxypropyl)-4-oxo-2-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-quinazoline-7-carboxylate CAS Name: 3-(3-methoxypropyl)-4-oxo-2-[[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]thio]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-(3-methoxypropyl)-4-oxo-2-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanylquinazoline-7-carboxylate Traditional Name: 4-keto-2-[[2-keto-2-(2,4,5-trimethylphenyl)ethyl]thio]-3-(3-methoxypropyl)quinazoline-7-carboxylic acid methyl ester Formula: C25H28N2O5S MolecularWeight: 468.56522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CCCOC)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CCCOC)C)C

InChI

InChI=1S/C25H28N2O5S/c1-15-11-17(3)20(12-16(15)2)22(28)14-33-25-26-21-13-18(24(30)32-5)7-8-19(21)23(29)27(25)9-6-10-31-4/h7-8,11-13H,6,9-10,14H2,1-5H3