(1S)-1-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-3-methyl-butan-1-amine

Systemtic Name: (1S)-1-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-3-methyl-butan-1-amine Openeye Name: (1S)-1-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-3-methyl-butan-1-amine CAS Name: (1S)-1-[5-[(4-tert-butylphenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]-3-methyl-1-butanamine IUPAC Name: (1S)-1-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-3-methylbutan-1-amine Traditional Name: [(1S)-1-[5-[(4-tert-butylbenzyl)thio]-4-methyl-1,2,4-triazol-3-yl]-3-methyl-butyl]amine Formula: C19H30N4S MolecularWeight: 346.5333

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NN=C(N1C)SCC2=CC=C(C=C2)C(C)(C)C)N

Isomeric SMILES

CC(C)C[C@@H](C1=NN=C(N1C)SCC2=CC=C(C=C2)C(C)(C)C)N

InChI

InChI=1S/C19H30N4S/c1-13(2)11-16(20)17-21-22-18(23(17)6)24-12-14-7-9-15(10-8-14)19(3,4)5/h7-10,13,16H,11-12,20H2,1-6H3/t16-/m0/s1