5-methyl-3-(2-methylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)quinazolin-4-one

Systemtic Name: 5-methyl-3-(2-methylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)quinazolin-4-one Openeye Name: 5-methyl-3-(o-tolyl)-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)quinazolin-4-one CAS Name: 5-methyl-3-(2-methylphenyl)-2-[(1H-1,2,4-triazol-5-ylthio)methyl]-4-quinazolinone IUPAC Name: 5-methyl-3-(2-methylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)quinazolin-4-one Traditional Name: 5-methyl-3-(o-tolyl)-2-[(1H-1,2,4-triazol-5-ylthio)methyl]quinazolin-4-one Formula: C19H17N5OS MolecularWeight: 363.43618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3C)CSC4=NC=NN4

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3C)CSC4=NC=NN4

InChI

InChI=1S/C19H17N5OS/c1-12-6-3-4-9-15(12)24-16(10-26-19-20-11-21-23-19)22-14-8-5-7-13(2)17(14)18(24)25/h3-9,11H,10H2,1-2H3,(H,20,21,23)