N-(3-ethanoylphenyl)-2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanamide Openeye Name: N-(3-acetylphenyl)-2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanamide CAS Name: N-(3-acetylphenyl)-2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]butanamide IUPAC Name: N-(3-acetylphenyl)-2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanamide Traditional Name: N-(3-acetylphenyl)-2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]butyramide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=CC=CC=C2)SC(CC)C(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CCC1=NN=C(N1C2=CC=CC=C2)SC(CC)C(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C22H24N4O2S/c1-4-19(21(28)23-17-11-9-10-16(14-17)15(3)27)29-22-25-24-20(5-2)26(22)18-12-7-6-8-13-18/h6-14,19H,4-5H2,1-3H3,(H,23,28)