2-(azepan-1-yl)-5-[(3,4-dimethoxyphenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-(azepan-1-yl)-5-[(3,4-dimethoxyphenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-(azepan-1-yl)-5-[(3,4-dimethoxyphenyl)methylene]thiazol-4-one CAS Name: 2-(1-azepanyl)-5-[(3,4-dimethoxyphenyl)methylidene]-4-thiazolone IUPAC Name: 2-(azepan-1-yl)-5-[(3,4-dimethoxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-(azepan-1-yl)-5-veratrylidene-2-thiazolin-4-one Formula: C18H22N2O3S MolecularWeight: 346.44388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2C(=O)N=C(S2)N3CCCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C=C2C(=O)N=C(S2)N3CCCCCC3)OC

InChI

InChI=1S/C18H22N2O3S/c1-22-14-8-7-13(11-15(14)23-2)12-16-17(21)19-18(24-16)20-9-5-3-4-6-10-20/h7-8,11-12H,3-6,9-10H2,1-2H3