methyl 3-[2-(diphenylmethyl)sulfanyl-4-oxidanylidene-quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[2-(diphenylmethyl)sulfanyl-4-oxidanylidene-quinazolin-3-yl]propanoate Openeye Name: methyl 3-(2-benzhydrylsulfanyl-4-oxo-quinazolin-3-yl)propanoate CAS Name: 3-[2-[(diphenylmethyl)thio]-4-oxo-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-(2-benzhydrylsulfanyl-4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-[2-(benzhydrylthio)-4-keto-quinazolin-3-yl]propionic acid methyl ester Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O3S/c1-30-22(28)16-17-27-24(29)20-14-8-9-15-21(20)26-25(27)31-23(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-15,23H,16-17H2,1H3