methyl 2-[2-(2-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[2-(2-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxylate Openeye Name: methyl 2-[2-(2-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-oxo-3-phenethyl-quinazoline-7-carboxylate CAS Name: 2-[[2-(2-methoxyphenyl)-2-oxoethyl]thio]-4-oxo-3-phenethyl-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(2-methoxyphenyl)-2-oxoethyl]sulfanyl-4-oxo-3-phenethylquinazoline-7-carboxylate Traditional Name: 4-keto-2-[[2-keto-2-(2-methoxyphenyl)ethyl]thio]-3-phenethyl-quinazoline-7-carboxylic acid methyl ester Formula: C27H24N2O5S MolecularWeight: 488.55486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CCC4=CC=CC=C4

InChI

InChI=1S/C27H24N2O5S/c1-33-24-11-7-6-10-21(24)23(30)17-35-27-28-22-16-19(26(32)34-2)12-13-20(22)25(31)29(27)15-14-18-8-4-3-5-9-18/h3-13,16H,14-15,17H2,1-2H3