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

Systemtic Name: 2-[[4-(3-chlorophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenethyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[4-(3-chlorophenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenethyl-thiazole-4-carboxamide CAS Name: 2-[[[4-(3-chlorophenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]-N-phenethyl-4-thiazolecarboxamide IUPAC Name: 2-[[4-(3-chlorophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-phenethyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[[4-(3-chlorophenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-N-phenethyl-thiazole-4-carboxamide Formula: C26H21ClN6OS2 MolecularWeight: 533.06754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=CSC(=N2)CSC3=NN=C(N3C4=CC(=CC=C4)Cl)C5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=CSC(=N2)CSC3=NN=C(N3C4=CC(=CC=C4)Cl)C5=CN=CC=C5

InChI

InChI=1S/C26H21ClN6OS2/c27-20-9-4-10-21(14-20)33-24(19-8-5-12-28-15-19)31-32-26(33)36-17-23-30-22(16-35-23)25(34)29-13-11-18-6-2-1-3-7-18/h1-10,12,14-16H,11,13,17H2,(H,29,34)