2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-phenethyl-N-(phenylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-phenethyl-N-(phenylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: N-benzyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-phenethyl-thiazole-4-carboxamide CAS Name: 2-[[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-N-phenethyl-N-(phenylmethyl)-4-thiazolecarboxamide IUPAC Name: N-benzyl-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-phenethyl-1,3-thiazole-4-carboxamide Traditional Name: N-benzyl-2-[[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-N-phenethyl-thiazole-4-carboxamide Formula: C29H27N5OS2 MolecularWeight: 525.68758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SCC3=NC(=CS3)C(=O)N(CCC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SCC3=NC(=CS3)C(=O)N(CCC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C29H27N5OS2/c1-22-31-32-29(34(22)25-15-9-4-10-16-25)37-21-27-30-26(20-36-27)28(35)33(19-24-13-7-3-8-14-24)18-17-23-11-5-2-6-12-23/h2-16,20H,17-19,21H2,1H3