3-(2-chlorophenyl)-2-(1H-1,2,4-triazol-5-ylmethyl)quinazolin-4-one

Systemtic Name: 3-(2-chlorophenyl)-2-(1H-1,2,4-triazol-5-ylmethyl)quinazolin-4-one Openeye Name: 3-(2-chlorophenyl)-2-(1H-1,2,4-triazol-5-ylmethyl)quinazolin-4-one CAS Name: 3-(2-chlorophenyl)-2-(1H-1,2,4-triazol-5-ylmethyl)-4-quinazolinone IUPAC Name: 3-(2-chlorophenyl)-2-(1H-1,2,4-triazol-5-ylmethyl)quinazolin-4-one Traditional Name: 3-(2-chlorophenyl)-2-(1H-1,2,4-triazol-5-ylmethyl)quinazolin-4-one Formula: C17H12ClN5O MolecularWeight: 337.76308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)CC3=NC=NN3)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)CC3=NC=NN3)C4=CC=CC=C4Cl

InChI

InChI=1S/C17H12ClN5O/c18-12-6-2-4-8-14(12)23-16(9-15-19-10-20-22-15)21-13-7-3-1-5-11(13)17(23)24/h1-8,10H,9H2,(H,19,20,22)