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

Systemtic Name: 2-[[4-(3-chlorophenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-(3-methylbutyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[5-benzyl-4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-isopentyl-thiazole-4-carboxamide CAS Name: 2-[[[4-(3-chlorophenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-N-(3-methylbutyl)-4-thiazolecarboxamide IUPAC Name: 2-[[5-benzyl-4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-(3-methylbutyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[[5-benzyl-4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]methyl]-N-isoamyl-thiazole-4-carboxamide Formula: C25H26ClN5OS2 MolecularWeight: 512.08984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC(=CC=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC(C)CCNC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC(=CC=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C25H26ClN5OS2/c1-17(2)11-12-27-24(32)21-15-33-23(28-21)16-34-25-30-29-22(13-18-7-4-3-5-8-18)31(25)20-10-6-9-19(26)14-20/h3-10,14-15,17H,11-13,16H2,1-2H3,(H,27,32)