[3-(azepan-1-ylsulfonyl)phenyl]-[4-(furan-2-ylcarbonyl)piperazin-1-yl]methanone

Systemtic Name: [3-(azepan-1-ylsulfonyl)phenyl]-[4-(furan-2-ylcarbonyl)piperazin-1-yl]methanone Openeye Name: [3-(azepan-1-ylsulfonyl)phenyl]-[4-(furan-2-carbonyl)piperazin-1-yl]methanone CAS Name: [3-(1-azepanylsulfonyl)phenyl]-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]methanone IUPAC Name: [3-(azepan-1-ylsulfonyl)phenyl]-[4-(furan-2-carbonyl)piperazin-1-yl]methanone Traditional Name: [3-(azepan-1-ylsulfonyl)phenyl]-[4-(2-furoyl)piperazino]methanone Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C22H27N3O5S/c26-21(23-12-14-24(15-13-23)22(27)20-9-6-16-30-20)18-7-5-8-19(17-18)31(28,29)25-10-3-1-2-4-11-25/h5-9,16-17H,1-4,10-15H2