2-[5-butylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 2-[5-butylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 2-(4-benzyl-5-butylsulfanyl-1,2,4-triazol-3-yl)pyridine CAS Name: 2-[5-(butylthio)-4-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 2-(4-benzyl-5-butylsulfanyl-1,2,4-triazol-3-yl)pyridine Traditional Name: 2-[4-benzyl-5-(butylthio)-1,2,4-triazol-3-yl]pyridine Formula: C18H20N4S MolecularWeight: 324.4432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CC=N3

Isomeric SMILES

CCCCSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CC=N3

InChI

InChI=1S/C18H20N4S/c1-2-3-13-23-18-21-20-17(16-11-7-8-12-19-16)22(18)14-15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3