methyl (2R)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate

Systemtic Name: methyl (2R)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate Openeye Name: methyl (2R)-2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanylpropanoate CAS Name: (2R)-2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate Traditional Name: (2R)-2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]propionic acid methyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)OC

Isomeric SMILES

C[C@H](C(=O)OC)SC1=NC2=CC=CC=C2C(=O)N1CC(C)C

InChI

InChI=1S/C16H20N2O3S/c1-10(2)9-18-14(19)12-7-5-6-8-13(12)17-16(18)22-11(3)15(20)21-4/h5-8,10-11H,9H2,1-4H3/t11-/m1/s1