4-(1H-1,2,4-triazol-5-ylsulfanyl)quinoline-3-carbonitrile

Systemtic Name: 4-(1H-1,2,4-triazol-5-ylsulfanyl)quinoline-3-carbonitrile Openeye Name: 4-(1H-1,2,4-triazol-5-ylsulfanyl)quinoline-3-carbonitrile CAS Name: 4-(1H-1,2,4-triazol-5-ylthio)-3-quinolinecarbonitrile IUPAC Name: 4-(1H-1,2,4-triazol-5-ylsulfanyl)quinoline-3-carbonitrile Traditional Name: 4-(1H-1,2,4-triazol-5-ylthio)quinoline-3-carbonitrile Formula: C12H7N5S MolecularWeight: 253.28248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=N2)C#N)SC3=NC=NN3

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=N2)C#N)SC3=NC=NN3

InChI

InChI=1S/C12H7N5S/c13-5-8-6-14-10-4-2-1-3-9(10)11(8)18-12-15-7-16-17-12/h1-4,6-7H,(H,15,16,17)