N-[3-(2,5-dimethylpyrrol-1-yl)-4-methyl-phenyl]-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-[3-(2,5-dimethylpyrrol-1-yl)-4-methyl-phenyl]-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-[3-(2,5-dimethylpyrrol-1-yl)-4-methyl-phenyl]-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[3-(2,5-dimethyl-1-pyrrolyl)-4-methylphenyl]-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-[3-(2,5-dimethylpyrrol-1-yl)-4-methylphenyl]-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-[3-(2,5-dimethylpyrrol-1-yl)-4-methyl-phenyl]-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C25H27N5O2S MolecularWeight: 461.57918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2C)COC3=CC=CC=C3)N4C(=CC=C4C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2C)COC3=CC=CC=C3)N4C(=CC=C4C)C

InChI

InChI=1S/C25H27N5O2S/c1-17-10-13-20(14-22(17)30-18(2)11-12-19(30)3)26-24(31)16-33-25-28-27-23(29(25)4)15-32-21-8-6-5-7-9-21/h5-14H,15-16H2,1-4H3,(H,26,31)