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

Systemtic Name: N-[1-(4-ethyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)ethyl]-4-methyl-benzamide Openeye Name: N-[1-(4-ethyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)ethyl]-4-methyl-benzamide CAS Name: N-[1-[4-ethyl-5-(phenacylthio)-1,2,4-triazol-3-yl]ethyl]-4-methylbenzamide IUPAC Name: N-[1-(4-ethyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)ethyl]-4-methylbenzamide Traditional Name: N-[1-[4-ethyl-5-(phenacylthio)-1,2,4-triazol-3-yl]ethyl]-4-methyl-benzamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O2S/c1-4-26-20(16(3)23-21(28)18-12-10-15(2)11-13-18)24-25-22(26)29-14-19(27)17-8-6-5-7-9-17/h5-13,16H,4,14H2,1-3H3,(H,23,28)