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

Systemtic Name: N-pentyl-2-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-pentyl-oxazole-4-carboxamide CAS Name: N-pentyl-2-[[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-4-oxazolecarboxamide IUPAC Name: 2-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-pentyl-1,3-oxazole-4-carboxamide Traditional Name: N-amyl-2-[[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]oxazole-4-carboxamide Formula: C25H27N5O2S MolecularWeight: 461.57918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=COC(=N1)CSC2=NN=C(N2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCCCCNC(=O)C1=COC(=N1)CSC2=NN=C(N2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H27N5O2S/c1-2-3-10-15-26-24(31)21-17-32-23(27-21)18-33-25-29-28-22(16-19-11-6-4-7-12-19)30(25)20-13-8-5-9-14-20/h4-9,11-14,17H,2-3,10,15-16,18H2,1H3,(H,26,31)