3-[(4-methyl-5-phenethyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-amine

Systemtic Name: 3-[(4-methyl-5-phenethyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-amine Openeye Name: 3-[(4-methyl-5-phenethyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-amine CAS Name: 3-[(4-methyl-5-phenethyl-1,2,4-triazol-3-yl)thio]-1-propanamine IUPAC Name: 3-[(4-methyl-5-phenethyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-amine Traditional Name: 3-[(4-methyl-5-phenethyl-1,2,4-triazol-3-yl)thio]propylamine Formula: C14H20N4S MolecularWeight: 276.4004

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCCN)CCC2=CC=CC=C2

Isomeric SMILES

CN1C(=NN=C1SCCCN)CCC2=CC=CC=C2

InChI

InChI=1S/C14H20N4S/c1-18-13(9-8-12-6-3-2-4-7-12)16-17-14(18)19-11-5-10-15/h2-4,6-7H,5,8-11,15H2,1H3