5-[[(2R)-2-(4-methoxyphenyl)azepan-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-[[(2R)-2-(4-methoxyphenyl)azepan-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole Openeye Name: 5-[[(2R)-2-(4-methoxyphenyl)azepan-1-yl]methyl]-3-(2-thienyl)-1,2,4-oxadiazole CAS Name: 5-[[(2R)-2-(4-methoxyphenyl)-1-azepanyl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole IUPAC Name: 5-[[(2R)-2-(4-methoxyphenyl)azepan-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole Traditional Name: 5-[[(2R)-2-(4-methoxyphenyl)azepan-1-yl]methyl]-3-(2-thienyl)-1,2,4-oxadiazole Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2CC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCCCCN2CC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C20H23N3O2S/c1-24-16-10-8-15(9-11-16)17-6-3-2-4-12-23(17)14-19-21-20(22-25-19)18-7-5-13-26-18/h5,7-11,13,17H,2-4,6,12,14H2,1H3/t17-/m1/s1