6-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile

Systemtic Name: 6-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile Openeye Name: 6-[[4-(4-chlorophenyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile CAS Name: 6-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]-3-pyridinecarbonitrile IUPAC Name: 6-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile Traditional Name: 6-[[4-(4-chlorophenyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]nicotinonitrile Formula: C19H11ClN6S MolecularWeight: 390.84884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=NN=C2SC3=NC=C(C=C3)C#N)C4=CC=NC=C4)Cl

Isomeric SMILES

C1=CC(=CC=C1N2C(=NN=C2SC3=NC=C(C=C3)C#N)C4=CC=NC=C4)Cl

InChI

InChI=1S/C19H11ClN6S/c20-15-2-4-16(5-3-15)26-18(14-7-9-22-10-8-14)24-25-19(26)27-17-6-1-13(11-21)12-23-17/h1-10,12H