5-[5-(azepan-1-ylsulfonyl)furan-2-yl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[5-(azepan-1-ylsulfonyl)furan-2-yl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-[5-(azepan-1-ylsulfonyl)-2-furyl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[5-(1-azepanylsulfonyl)-2-furanyl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[5-(azepan-1-ylsulfonyl)furan-2-yl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[5-(azepan-1-ylsulfonyl)-2-furyl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NOC(=N2)C3=CC=C(O3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NOC(=N2)C3=CC=C(O3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C19H21N3O5S/c1-25-15-8-6-7-14(13-15)18-20-19(27-21-18)16-9-10-17(26-16)28(23,24)22-11-4-2-3-5-12-22/h6-10,13H,2-5,11-12H2,1H3