methyl (2R)-2-[7-chloranyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate

Systemtic Name: methyl (2R)-2-[7-chloranyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate Openeye Name: methyl (2R)-2-[7-chloro-3-(m-tolyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoate CAS Name: (2R)-2-[[7-chloro-3-(3-methylphenyl)-4-oxo-2-quinazolinyl]thio]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[7-chloro-3-(3-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate Traditional Name: (2R)-2-[[7-chloro-4-keto-3-(m-tolyl)quinazolin-2-yl]thio]propionic acid methyl ester Formula: C19H17ClN2O3S MolecularWeight: 388.86788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SC(C)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2S[C@H](C)C(=O)OC

InChI

InChI=1S/C19H17ClN2O3S/c1-11-5-4-6-14(9-11)22-17(23)15-8-7-13(20)10-16(15)21-19(22)26-12(2)18(24)25-3/h4-10,12H,1-3H3/t12-/m1/s1