2-[3-(4-fluoranylphenoxy)propylsulfanyl]-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one

Systemtic Name: 2-[3-(4-fluoranylphenoxy)propylsulfanyl]-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Openeye Name: 2-[3-(4-fluorophenoxy)propylsulfanyl]-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one CAS Name: 2-[3-(4-fluorophenoxy)propylthio]-3-(1H-1,2,4-triazol-5-yl)-4-quinazolinone IUPAC Name: 2-[3-(4-fluorophenoxy)propylsulfanyl]-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Traditional Name: 2-[3-(4-fluorophenoxy)propylthio]-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Formula: C19H16FN5O2S MolecularWeight: 397.426043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCCOC3=CC=C(C=C3)F)C4=NC=NN4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCCOC3=CC=C(C=C3)F)C4=NC=NN4

InChI

InChI=1S/C19H16FN5O2S/c20-13-6-8-14(9-7-13)27-10-3-11-28-19-23-16-5-2-1-4-15(16)17(26)25(19)18-21-12-22-24-18/h1-2,4-9,12H,3,10-11H2,(H,21,22,24)