5-phenyl-2-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazole-3-thione

Systemtic Name: 5-phenyl-2-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazole-3-thione Openeye Name: 5-phenyl-2-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazole-3-thione CAS Name: 5-phenyl-2-(1-pyrrolidinylmethyl)-1H-1,2,4-triazole-3-thione IUPAC Name: 5-phenyl-2-(pyrrolidin-1-ylmethyl)-1H-1,2,4-triazole-3-thione Traditional Name: 5-phenyl-2-(pyrrolidinomethyl)-1H-1,2,4-triazole-3-thione Formula: C13H16N4S MolecularWeight: 260.35794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CN2C(=S)N=C(N2)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)CN2C(=S)N=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C13H16N4S/c18-13-14-12(11-6-2-1-3-7-11)15-17(13)10-16-8-4-5-9-16/h1-3,6-7H,4-5,8-10H2,(H,14,15,18)