2-[1-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[1-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethyl]-1H-quinazolin-4-one Openeye Name: 2-[1-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethyl]-1H-quinazolin-4-one CAS Name: 2-[1-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[1-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethyl]-1H-quinazolin-4-one Traditional Name: 2-[1-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]ethyl]-1H-quinazolin-4-one Formula: C19H17N5O2S MolecularWeight: 379.43558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)SC3=NNC(=N3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)SC3=NNC(=N3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C19H17N5O2S/c1-11(16-20-15-6-4-3-5-14(15)18(25)21-16)27-19-22-17(23-24-19)12-7-9-13(26-2)10-8-12/h3-11H,1-2H3,(H,20,21,25)(H,22,23,24)