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

Systemtic Name: N-hexyl-2-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-hexyl-thiazole-4-carboxamide CAS Name: N-hexyl-2-[[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolecarboxamide IUPAC Name: 2-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-hexyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-N-hexyl-thiazole-4-carboxamide Formula: C26H29N5OS2 MolecularWeight: 491.67136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29N5OS2/c1-2-3-4-11-16-27-25(32)22-18-33-24(28-22)19-34-26-30-29-23(17-20-12-7-5-8-13-20)31(26)21-14-9-6-10-15-21/h5-10,12-15,18H,2-4,11,16-17,19H2,1H3,(H,27,32)