2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-one CAS Name: 2-[[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-one Traditional Name: 3-benzyl-2-[[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]quinazolin-4-one Formula: C26H23N5O2S MolecularWeight: 469.55812

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C5=CC=C(C=C5)OC

Isomeric SMILES

CN1C(=NN=C1SCC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C26H23N5O2S/c1-30-24(19-12-14-20(33-2)15-13-19)28-29-26(30)34-17-23-27-22-11-7-6-10-21(22)25(32)31(23)16-18-8-4-3-5-9-18/h3-15H,16-17H2,1-2H3