methyl 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-4-oxidanylidene-3-(phenylmethyl)quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-4-oxidanylidene-3-(phenylmethyl)quinazoline-7-carboxylate Openeye Name: methyl 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-3-benzyl-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-4-oxo-3-(phenylmethyl)-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-3-benzyl-4-oxoquinazoline-7-carboxylate Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-3-benzyl-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C27H24N2O5S MolecularWeight: 488.55486

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C27H24N2O5S/c1-17(30)19-10-12-24(33-2)21(13-19)16-35-27-28-23-14-20(26(32)34-3)9-11-22(23)25(31)29(27)15-18-7-5-4-6-8-18/h4-14H,15-16H2,1-3H3