2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-1-[5-(furan-2-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-1-[5-(furan-2-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-[4-(azepane-1-carbonyl)-1-piperidyl]-1-[5-(2-furyl)-3-(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-1-[5-(2-furanyl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-[4-(azepane-1-carbonyl)piperidin-1-yl]-1-[5-(furan-2-yl)-3-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-[4-(azepane-1-carbonyl)piperidino]-1-[3-(2-furyl)-5-(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C25H32N4O3S MolecularWeight: 468.61158

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)CC(=O)N3C(CC(=N3)C4=CC=CO4)C5=CC=CS5

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)CC(=O)N3C(CC(=N3)C4=CC=CO4)C5=CC=CS5

InChI

InChI=1S/C25H32N4O3S/c30-24(18-27-13-9-19(10-14-27)25(31)28-11-3-1-2-4-12-28)29-21(23-8-6-16-33-23)17-20(26-29)22-7-5-15-32-22/h5-8,15-16,19,21H,1-4,9-14,17-18H2