2-chloranyl-5-[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine

Systemtic Name: 2-chloranyl-5-[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Openeye Name: 2-chloro-5-[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine CAS Name: 2-chloro-5-[[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]methyl]pyridine IUPAC Name: 2-chloro-5-[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Traditional Name: 2-chloro-5-[[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]methyl]pyridine Formula: C21H23ClN4OS MolecularWeight: 414.95152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCC4=CN=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCC4=CN=C(C=C4)Cl

InChI

InChI=1S/C21H23ClN4OS/c1-27-18-10-8-16(9-11-18)20-24-25-21(26(20)17-5-3-2-4-6-17)28-14-15-7-12-19(22)23-13-15/h7-13,17H,2-6,14H2,1H3