N-(2-methylbutan-2-yl)-2-[[4-(4-methylphenyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-methylbutan-2-yl)-2-[[4-(4-methylphenyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(1,1-dimethylpropyl)-2-[[4-(p-tolyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-methylbutan-2-yl)-2-[[4-(4-methylphenyl)-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-methylbutan-2-yl)-2-[[4-(4-methylphenyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-tert-amyl-2-[[4-(p-tolyl)-5-pyrrolidino-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H29N5OS MolecularWeight: 387.54216

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)C)N3CCCC3

Isomeric SMILES

CCC(C)(C)NC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)C)N3CCCC3

InChI

InChI=1S/C20H29N5OS/c1-5-20(3,4)21-17(26)14-27-19-23-22-18(24-12-6-7-13-24)25(19)16-10-8-15(2)9-11-16/h8-11H,5-7,12-14H2,1-4H3,(H,21,26)