propan-2-yl 2-[3-(4-cyanophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: propan-2-yl 2-[3-(4-cyanophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: isopropyl 2-[3-(4-cyanophenyl)-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[3-(4-cyanophenyl)-4-oxo-2-quinazolinyl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[3-(4-cyanophenyl)-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[3-(4-cyanophenyl)-4-keto-quinazolin-2-yl]thio]acetic acid isopropyl ester Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)OC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H17N3O3S/c1-13(2)26-18(24)12-27-20-22-17-6-4-3-5-16(17)19(25)23(20)15-9-7-14(11-21)8-10-15/h3-10,13H,12H2,1-2H3