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

Systemtic Name: 3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-amine Openeye Name: 3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-amine CAS Name: 3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)thio]-1-propanamine IUPAC Name: 3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-amine Traditional Name: 3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)thio]propylamine Formula: C17H24N4S MolecularWeight: 316.46426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC(=NN2C3=CC=CC=C3)SCCCN

Isomeric SMILES

C1CCC(CC1)C2=NC(=NN2C3=CC=CC=C3)SCCCN

InChI

InChI=1S/C17H24N4S/c18-12-7-13-22-17-19-16(14-8-3-1-4-9-14)21(20-17)15-10-5-2-6-11-15/h2,5-6,10-11,14H,1,3-4,7-9,12-13,18H2