1-(azepan-1-yl)-2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[2-(3,4-dimethoxyphenyl)thiazol-4-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[2-(3,4-dimethoxyphenyl)-4-thiazolyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[2-(3,4-dimethoxyphenyl)thiazol-4-yl]ethanone Formula: C19H24N2O3S MolecularWeight: 360.47046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)CC(=O)N3CCCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)CC(=O)N3CCCCCC3)OC

InChI

InChI=1S/C19H24N2O3S/c1-23-16-8-7-14(11-17(16)24-2)19-20-15(13-25-19)12-18(22)21-9-5-3-4-6-10-21/h7-8,11,13H,3-6,9-10,12H2,1-2H3