2-(6-chloranyl-3-methyl-4-phenyl-2-sulfanylidene-1H-quinazolin-4-yl)ethanoic acid

Systemtic Name: 2-(6-chloranyl-3-methyl-4-phenyl-2-sulfanylidene-1H-quinazolin-4-yl)ethanoic acid Openeye Name: 2-(6-chloro-3-methyl-4-phenyl-2-thioxo-1H-quinazolin-4-yl)acetic acid CAS Name: 2-(6-chloro-3-methyl-4-phenyl-2-sulfanylidene-1H-quinazolin-4-yl)acetic acid IUPAC Name: 2-(6-chloro-3-methyl-4-phenyl-2-sulfanylidene-1H-quinazolin-4-yl)acetic acid Traditional Name: 2-(6-chloro-3-methyl-4-phenyl-2-thioxo-1H-quinazolin-4-yl)acetic acid Formula: C17H15ClN2O2S MolecularWeight: 346.8312

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=S)NC2=C(C1(CC(=O)O)C3=CC=CC=C3)C=C(C=C2)Cl

Isomeric SMILES

CN1C(=S)NC2=C(C1(CC(=O)O)C3=CC=CC=C3)C=C(C=C2)Cl

InChI

InChI=1S/C17H15ClN2O2S/c1-20-16(23)19-14-8-7-12(18)9-13(14)17(20,10-15(21)22)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,19,23)(H,21,22)