N-[1-(4-ethyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)-2-methyl-propyl]-3-methyl-benzamide

Systemtic Name: N-[1-(4-ethyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)-2-methyl-propyl]-3-methyl-benzamide Openeye Name: N-[1-(4-ethyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)-2-methyl-propyl]-3-methyl-benzamide CAS Name: N-[1-[4-ethyl-5-(phenacylthio)-1,2,4-triazol-3-yl]-2-methylpropyl]-3-methylbenzamide IUPAC Name: N-[1-(4-ethyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)-2-methylpropyl]-3-methylbenzamide Traditional Name: N-[1-[4-ethyl-5-(phenacylthio)-1,2,4-triazol-3-yl]-2-methyl-propyl]-3-methyl-benzamide Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)C2=CC=CC=C2)C(C(C)C)NC(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)C2=CC=CC=C2)C(C(C)C)NC(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C24H28N4O2S/c1-5-28-22(21(16(2)3)25-23(30)19-13-9-10-17(4)14-19)26-27-24(28)31-15-20(29)18-11-7-6-8-12-18/h6-14,16,21H,5,15H2,1-4H3,(H,25,30)