4-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]aniline

Systemtic Name: 4-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]aniline Openeye Name: 4-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]aniline CAS Name: 4-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]ethyl]aniline IUPAC Name: 4-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]aniline Traditional Name: [4-[2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]ethyl]phenyl]amine Formula: C16H20N4S MolecularWeight: 300.4218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCCC4=CC=C(C=C4)N

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCCC4=CC=C(C=C4)N

InChI

InChI=1S/C16H20N4S/c17-13-5-1-11(2-6-13)9-10-21-16-19-18-15(12-3-4-12)20(16)14-7-8-14/h1-2,5-6,12,14H,3-4,7-10,17H2