4-[4-(3-chloranyl-2-methyl-phenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[4-(3-chloranyl-2-methyl-phenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-(3-chloro-2-methyl-phenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-(3-chloro-2-methylphenyl)-5-(propylthio)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-(3-chloro-2-methylphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[4-(3-chloro-2-methyl-phenyl)-5-(propylthio)-1,2,4-triazol-3-yl]pyridine Formula: C17H17ClN4S MolecularWeight: 344.86168

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C2=C(C(=CC=C2)Cl)C)C3=CC=NC=C3

Isomeric SMILES

CCCSC1=NN=C(N1C2=C(C(=CC=C2)Cl)C)C3=CC=NC=C3

InChI

InChI=1S/C17H17ClN4S/c1-3-11-23-17-21-20-16(13-7-9-19-10-8-13)22(17)15-6-4-5-14(18)12(15)2/h4-10H,3,11H2,1-2H3