N-[5-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-2-methyl-phenyl]furan-2-carboxamide

Systemtic Name: N-[5-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-2-methyl-phenyl]furan-2-carboxamide Openeye Name: N-[5-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-2-methyl-phenyl]furan-2-carboxamide CAS Name: N-[5-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]-2-methylphenyl]-2-furancarboxamide IUPAC Name: N-[5-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-2-methylphenyl]furan-2-carboxamide Traditional Name: N-[5-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-2-methyl-phenyl]-2-furamide Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C25H31N3O4/c1-18-8-9-20(17-21(18)26-23(29)22-7-6-16-32-22)25(31)28-14-10-19(11-15-28)24(30)27-12-4-2-3-5-13-27/h6-9,16-17,19H,2-5,10-15H2,1H3,(H,26,29)