2-[[4-ethyl-5-[3-(4-methoxy-3-methyl-phenyl)propyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-ethyl-5-[3-(4-methoxy-3-methyl-phenyl)propyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-ethyl-5-[3-(4-methoxy-3-methyl-phenyl)propyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[4-ethyl-5-[3-(4-methoxy-3-methylphenyl)propyl]-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-ethyl-5-[3-(4-methoxy-3-methylphenyl)propyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[4-ethyl-5-[3-(4-methoxy-3-methyl-phenyl)propyl]-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one Formula: C24H27N5O2S MolecularWeight: 449.56848

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)CCCC4=CC(=C(C=C4)OC)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)CCCC4=CC(=C(C=C4)OC)C

InChI

InChI=1S/C24H27N5O2S/c1-4-29-22(11-7-8-17-12-13-20(31-3)16(2)14-17)27-28-24(29)32-15-21-25-19-10-6-5-9-18(19)23(30)26-21/h5-6,9-10,12-14H,4,7-8,11,15H2,1-3H3,(H,25,26,30)