2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile

Systemtic Name: 2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile Openeye Name: 2-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile CAS Name: 2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]thio]-3-pyridinecarbonitrile IUPAC Name: 2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile Traditional Name: 2-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]thio]nicotinonitrile Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SC2=C(C=CC=N2)C#N)C3=CC(=CC=C3)C

Isomeric SMILES

CCCN1C(=NN=C1SC2=C(C=CC=N2)C#N)C3=CC(=CC=C3)C

InChI

InChI=1S/C18H17N5S/c1-3-10-23-16(14-7-4-6-13(2)11-14)21-22-18(23)24-17-15(12-19)8-5-9-20-17/h4-9,11H,3,10H2,1-2H3