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

Systemtic Name: (5Z)-2-(azepan-1-yl)-5-[(2-ethoxyphenyl)methylidene]-1,3-thiazol-4-one Openeye Name: (5Z)-2-(azepan-1-yl)-5-[(2-ethoxyphenyl)methylene]thiazol-4-one CAS Name: (5Z)-2-(1-azepanyl)-5-[(2-ethoxyphenyl)methylidene]-4-thiazolone IUPAC Name: (5Z)-2-(azepan-1-yl)-5-[(2-ethoxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5Z)-2-(azepan-1-yl)-5-(2-ethoxybenzylidene)-2-thiazolin-4-one Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C=C2C(=O)N=C(S2)N3CCCCCC3

Isomeric SMILES

CCOC1=CC=CC=C1/C=C\2/C(=O)N=C(S2)N3CCCCCC3

InChI

InChI=1S/C18H22N2O2S/c1-2-22-15-10-6-5-9-14(15)13-16-17(21)19-18(23-16)20-11-7-3-4-8-12-20/h5-6,9-10,13H,2-4,7-8,11-12H2,1H3/b16-13-