1-[[5-(furan-2-yl)-1-(4-methylphenyl)-1,2,4-triazol-3-yl]carbonyl]piperidine-4-carboxamide

Systemtic Name: 1-[[5-(furan-2-yl)-1-(4-methylphenyl)-1,2,4-triazol-3-yl]carbonyl]piperidine-4-carboxamide Openeye Name: 1-[5-(2-furyl)-1-(p-tolyl)-1,2,4-triazole-3-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[5-(2-furanyl)-1-(4-methylphenyl)-1,2,4-triazol-3-yl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[5-(furan-2-yl)-1-(4-methylphenyl)-1,2,4-triazole-3-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[5-(2-furyl)-1-(p-tolyl)-1,2,4-triazole-3-carbonyl]isonipecotamide Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NC(=N2)C(=O)N3CCC(CC3)C(=O)N)C4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NC(=N2)C(=O)N3CCC(CC3)C(=O)N)C4=CC=CO4

InChI

InChI=1S/C20H21N5O3/c1-13-4-6-15(7-5-13)25-19(16-3-2-12-28-16)22-18(23-25)20(27)24-10-8-14(9-11-24)17(21)26/h2-7,12,14H,8-11H2,1H3,(H2,21,26)