tert-butyl N-[[5-(2-methylprop-2-enylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[5-(2-methylprop-2-enylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]carbamate Openeye Name: tert-butyl N-[[5-(2-methylallylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]carbamate CAS Name: N-[[5-(2-methylprop-2-enylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[5-(2-methylprop-2-enylsulfanyl)-4-phenyl-1,2,4-triazol-3-yl]methyl]carbamate Traditional Name: N-[[5-(2-methylallylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]carbamic acid tert-butyl ester Formula: C18H24N4O2S MolecularWeight: 360.47376

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NN=C(N1C2=CC=CC=C2)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC(=C)CSC1=NN=C(N1C2=CC=CC=C2)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C18H24N4O2S/c1-13(2)12-25-16-21-20-15(11-19-17(23)24-18(3,4)5)22(16)14-9-7-6-8-10-14/h6-10H,1,11-12H2,2-5H3,(H,19,23)