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

Systemtic Name: 2-(azepan-1-yl)-5-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-(azepan-1-yl)-5-[(4-hydroxy-3-methoxy-phenyl)methylene]thiazol-4-one CAS Name: 2-(1-azepanyl)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-thiazolone IUPAC Name: 2-(azepan-1-yl)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 2-(azepan-1-yl)-5-vanillylidene-2-thiazolin-4-one Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O3S/c1-22-14-10-12(6-7-13(14)20)11-15-16(21)18-17(23-15)19-8-4-2-3-5-9-19/h6-7,10-11,20H,2-5,8-9H2,1H3