3-[5-(9H-fluoren-9-ylsulfanyl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[5-(9H-fluoren-9-ylsulfanyl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-(9H-fluoren-9-ylsulfanyl)-4-isobutyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-(9H-fluoren-9-ylthio)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-(9H-fluoren-9-ylsulfanyl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-(9H-fluoren-9-ylthio)-4-isobutyl-1,2,4-triazol-3-yl]propionamide Formula: C22H24N4OS MolecularWeight: 392.51716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SC2C3=CC=CC=C3C4=CC=CC=C24)CCC(=O)N

Isomeric SMILES

CC(C)CN1C(=NN=C1SC2C3=CC=CC=C3C4=CC=CC=C24)CCC(=O)N

InChI

InChI=1S/C22H24N4OS/c1-14(2)13-26-20(12-11-19(23)27)24-25-22(26)28-21-17-9-5-3-7-15(17)16-8-4-6-10-18(16)21/h3-10,14,21H,11-13H2,1-2H3,(H2,23,27)