(2R)-2-[3-(2,4-dichlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate

Systemtic Name: (2R)-2-[3-(2,4-dichlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate Openeye Name: (2R)-2-[3-(2,4-dichlorophenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoate CAS Name: (2R)-2-[[3-(2,4-dichlorophenyl)-4-oxo-2-quinazolinyl]thio]propanoate IUPAC Name: (2R)-2-[3-(2,4-dichlorophenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate Traditional Name: (2R)-2-[[3-(2,4-dichlorophenyl)-4-keto-quinazolin-2-yl]thio]propionate Formula: C17H11Cl2N2O3S- MolecularWeight: 394.25184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SC1=NC2=CC=CC=C2C(=O)N1C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C[C@H](C(=O)[O-])SC1=NC2=CC=CC=C2C(=O)N1C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H12Cl2N2O3S/c1-9(16(23)24)25-17-20-13-5-3-2-4-11(13)15(22)21(17)14-7-6-10(18)8-12(14)19/h2-9H,1H3,(H,23,24)/p-1/t9-/m1/s1