[3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]methanamine

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC4=CC=CC(=C4)CN

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCC4=CC=CC(=C4)CN

InChI

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