N-butyl-2-[[4-(5-chloranyl-2-methyl-phenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-butyl-2-[[4-(5-chloranyl-2-methyl-phenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-butyl-2-[[4-(5-chloro-2-methyl-phenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazole-4-carboxamide CAS Name: N-butyl-2-[[[4-(5-chloro-2-methylphenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolecarboxamide IUPAC Name: N-butyl-2-[[4-(5-chloro-2-methylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-butyl-2-[[[4-(5-chloro-2-methyl-phenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole-4-carboxamide Formula: C23H23ClN6OS2 MolecularWeight: 499.05132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=C(C=CC(=C3)Cl)C)C4=CN=CC=C4

Isomeric SMILES

CCCCNC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=C(C=CC(=C3)Cl)C)C4=CN=CC=C4

InChI

InChI=1S/C23H23ClN6OS2/c1-3-4-10-26-22(31)18-13-32-20(27-18)14-33-23-29-28-21(16-6-5-9-25-12-16)30(23)19-11-17(24)8-7-15(19)2/h5-9,11-13H,3-4,10,14H2,1-2H3,(H,26,31)