2-(2-chlorophenyl)-3-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)quinazolin-4-one

Systemtic Name: 2-(2-chlorophenyl)-3-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)quinazolin-4-one Openeye Name: 2-(2-chlorophenyl)-3-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)quinazolin-4-one CAS Name: 2-(2-chlorophenyl)-3-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-4-quinazolinone IUPAC Name: 2-(2-chlorophenyl)-3-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)quinazolin-4-one Traditional Name: 2-(2-chlorophenyl)-3-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)quinazolin-4-one Formula: C19H16ClN5OS MolecularWeight: 397.88124

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1N2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4Cl

Isomeric SMILES

CCCC1=NNC(=S)N1N2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C19H16ClN5OS/c1-2-7-16-22-23-19(27)24(16)25-17(12-8-3-5-10-14(12)20)21-15-11-6-4-9-13(15)18(25)26/h3-6,8-11H,2,7H2,1H3,(H,23,27)