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

Systemtic Name: 4-[5-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-4-propyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-4-propyl-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylthio]-4-propyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylsulfanyl]-4-propyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylthio]-4-propyl-1,2,4-triazol-3-yl]pyridine Formula: C21H21ClN6S MolecularWeight: 424.94964

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC2=C(N(N=C2C)C3=CC=CC=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

CCCN1C(=NN=C1SCC2=C(N(N=C2C)C3=CC=CC=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C21H21ClN6S/c1-3-13-27-20(16-9-11-23-12-10-16)24-25-21(27)29-14-18-15(2)26-28(19(18)22)17-7-5-4-6-8-17/h4-12H,3,13-14H2,1-2H3