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

Systemtic Name: 2-[2-(4-chloranylphenoxy)ethylsulfanyl]-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Openeye Name: 2-[2-(4-chlorophenoxy)ethylsulfanyl]-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one CAS Name: 2-[2-(4-chlorophenoxy)ethylthio]-3-(1H-1,2,4-triazol-5-yl)-4-quinazolinone IUPAC Name: 2-[2-(4-chlorophenoxy)ethylsulfanyl]-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Traditional Name: 2-[2-(4-chlorophenoxy)ethylthio]-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Formula: C18H14ClN5O2S MolecularWeight: 399.85406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCOC3=CC=C(C=C3)Cl)C4=NC=NN4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCOC3=CC=C(C=C3)Cl)C4=NC=NN4

InChI

InChI=1S/C18H14ClN5O2S/c19-12-5-7-13(8-6-12)26-9-10-27-18-22-15-4-2-1-3-14(15)16(25)24(18)17-20-11-21-23-17/h1-8,11H,9-10H2,(H,20,21,23)