methyl 4-[[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]benzoate Openeye Name: methyl 4-[[3-[(4-methoxyphenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanylmethyl]benzoate CAS Name: 4-[[[3-[(4-methoxyphenyl)methyl]-4-oxo-2-quinazolinyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-[(4-methoxyphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanylmethyl]benzoate Traditional Name: 4-[[(4-keto-3-p-anisyl-quinazolin-2-yl)thio]methyl]benzoic acid methyl ester Formula: C25H22N2O4S MolecularWeight: 446.51818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C25H22N2O4S/c1-30-20-13-9-17(10-14-20)15-27-23(28)21-5-3-4-6-22(21)26-25(27)32-16-18-7-11-19(12-8-18)24(29)31-2/h3-14H,15-16H2,1-2H3