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

Systemtic Name: N-butyl-2-[[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-oxazole-4-carboxamide Openeye Name: N-butyl-2-[[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]oxazole-4-carboxamide CAS Name: N-butyl-2-[[[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-4-oxazolecarboxamide IUPAC Name: N-butyl-2-[[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-oxazole-4-carboxamide Traditional Name: N-butyl-2-[[[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]oxazole-4-carboxamide Formula: C23H22ClN5O2S MolecularWeight: 467.97108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=COC(=N1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4Cl

Isomeric SMILES

CCCCNC(=O)C1=COC(=N1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4Cl

InChI

InChI=1S/C23H22ClN5O2S/c1-2-3-13-25-22(30)19-14-31-20(26-19)15-32-23-28-27-21(17-11-7-8-12-18(17)24)29(23)16-9-5-4-6-10-16/h4-12,14H,2-3,13,15H2,1H3,(H,25,30)