2-[[4-(4-methylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-propyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[4-(4-methylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-propyl-1,3-thiazole-4-carboxamide Openeye Name: N-propyl-2-[[4-(p-tolyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazole-4-carboxamide CAS Name: 2-[[[4-(4-methylphenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]-N-propyl-4-thiazolecarboxamide IUPAC Name: 2-[[4-(4-methylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-propyl-1,3-thiazole-4-carboxamide Traditional Name: N-propyl-2-[[[4-(p-tolyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole-4-carboxamide Formula: C22H22N6OS2 MolecularWeight: 450.57968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N6OS2/c1-3-10-24-21(29)18-13-30-19(25-18)14-31-22-27-26-20(16-5-4-11-23-12-16)28(22)17-8-6-15(2)7-9-17/h4-9,11-13H,3,10,14H2,1-2H3,(H,24,29)