N-(3,5-dimethylphenyl)-4-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Openeye Name: N-(3,5-dimethylphenyl)-4-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide CAS Name: N-(3,5-dimethylphenyl)-4-[[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]methyl]benzamide IUPAC Name: N-(3,5-dimethylphenyl)-4-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Traditional Name: N-(3,5-dimethylphenyl)-4-[[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]benzamide Formula: C25H25N5OS MolecularWeight: 443.5639

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)C(=O)NC3=CC(=CC(=C3)C)C)C4=CC=NC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)C(=O)NC3=CC(=CC(=C3)C)C)C4=CC=NC=C4

InChI

InChI=1S/C25H25N5OS/c1-4-30-23(20-9-11-26-12-10-20)28-29-25(30)32-16-19-5-7-21(8-6-19)24(31)27-22-14-17(2)13-18(3)15-22/h5-15H,4,16H2,1-3H3,(H,27,31)