4-[(Z)-(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-1,5-dimethyl-pyrrole-2-carbonitrile

Systemtic Name: 4-[(Z)-(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[(Z)-(3-ethyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[(Z)-(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[(Z)-(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[(Z)-(3-ethyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C12H14N6S MolecularWeight: 274.34476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1N=CC2=C(N(C(=C2)C#N)C)C

Isomeric SMILES

CCC1=NNC(=S)N1/N=C\C2=C(N(C(=C2)C#N)C)C

InChI

InChI=1S/C12H14N6S/c1-4-11-15-16-12(19)18(11)14-7-9-5-10(6-13)17(3)8(9)2/h5,7H,4H2,1-3H3,(H,16,19)/b14-7-