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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=NN=C2SC(C)C)C3=CC=NC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=NN=C2SC(C)C)C3=CC=NC=C3

InChI

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