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

Systemtic Name: methyl 3-[[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanylmethyl]benzoate Openeye Name: methyl 3-[(3-benzyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]benzoate CAS Name: 3-[[[4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(3-benzyl-4-oxoquinazolin-2-yl)sulfanylmethyl]benzoate Traditional Name: 3-[[(3-benzyl-4-keto-quinazolin-2-yl)thio]methyl]benzoic acid methyl ester Formula: C24H20N2O3S MolecularWeight: 416.4922

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C24H20N2O3S/c1-29-23(28)19-11-7-10-18(14-19)16-30-24-25-21-13-6-5-12-20(21)22(27)26(24)15-17-8-3-2-4-9-17/h2-14H,15-16H2,1H3