4-phenethyl-3-(quinolin-8-ylmethylsulfanyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 4-phenethyl-3-(quinolin-8-ylmethylsulfanyl)-1H-1,2,4-triazol-5-one Openeye Name: 4-phenethyl-3-(8-quinolylmethylsulfanyl)-1H-1,2,4-triazol-5-one CAS Name: 4-phenethyl-3-(8-quinolinylmethylthio)-1H-1,2,4-triazol-5-one IUPAC Name: 4-phenethyl-3-(quinolin-8-ylmethylsulfanyl)-1H-1,2,4-triazol-5-one Traditional Name: 4-phenethyl-3-(8-quinolylmethylthio)-1H-1,2,4-triazol-5-one Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)NN=C2SCC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)NN=C2SCC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C20H18N4OS/c25-19-22-23-20(24(19)13-11-15-6-2-1-3-7-15)26-14-17-9-4-8-16-10-5-12-21-18(16)17/h1-10,12H,11,13-14H2,(H,22,25)