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

Systemtic Name: 2-[1-[[5-(2-methoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]-1H-quinazolin-4-one Openeye Name: 2-[1-[[5-(2-methoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]-1H-quinazolin-4-one CAS Name: 2-[1-[[5-(2-methoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]thio]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[1-[[5-(2-methoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]-1H-quinazolin-4-one Traditional Name: 2-[1-[[5-(2-methoxyphenyl)-4-phenethyl-1,2,4-triazol-3-yl]thio]ethyl]-1H-quinazolin-4-one Formula: C27H25N5O2S MolecularWeight: 483.5847

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)SC3=NN=C(N3CCC4=CC=CC=C4)C5=CC=CC=C5OC

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)SC3=NN=C(N3CCC4=CC=CC=C4)C5=CC=CC=C5OC

InChI

InChI=1S/C27H25N5O2S/c1-18(24-28-22-14-8-6-12-20(22)26(33)29-24)35-27-31-30-25(21-13-7-9-15-23(21)34-2)32(27)17-16-19-10-4-3-5-11-19/h3-15,18H,16-17H2,1-2H3,(H,28,29,33)