3-[(4-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-methyl-amino]propanenitrile

Systemtic Name: 3-[(4-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-methyl-amino]propanenitrile Openeye Name: 3-[(4-cyclopropyl-5-thioxo-1H-1,2,4-triazol-3-yl)-methyl-amino]propanenitrile CAS Name: 3-[(4-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-methylamino]propanenitrile IUPAC Name: 3-[(4-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-methylamino]propanenitrile Traditional Name: 3-[(4-cyclopropyl-5-thioxo-1H-1,2,4-triazol-3-yl)-methyl-amino]propionitrile Formula: C9H13N5S MolecularWeight: 223.29802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C1=NNC(=S)N1C2CC2

Isomeric SMILES

CN(CCC#N)C1=NNC(=S)N1C2CC2

InChI

InChI=1S/C9H13N5S/c1-13(6-2-5-10)8-11-12-9(15)14(8)7-3-4-7/h7H,2-4,6H2,1H3,(H,12,15)