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

Systemtic Name: 2-(azepan-1-yl)-5-[(3-methoxy-4-pentoxy-phenyl)methylidene]-1,3-thiazol-4-one Openeye Name: 2-(azepan-1-yl)-5-[(3-methoxy-4-pentoxy-phenyl)methylene]thiazol-4-one CAS Name: 2-(1-azepanyl)-5-[(3-methoxy-4-pentoxyphenyl)methylidene]-4-thiazolone IUPAC Name: 2-(azepan-1-yl)-5-[(3-methoxy-4-pentoxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: 5-(4-amoxy-3-methoxy-benzylidene)-2-(azepan-1-yl)-2-thiazolin-4-one Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C=C2C(=O)N=C(S2)N3CCCCCC3)OC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)C=C2C(=O)N=C(S2)N3CCCCCC3)OC

InChI

InChI=1S/C22H30N2O3S/c1-3-4-9-14-27-18-11-10-17(15-19(18)26-2)16-20-21(25)23-22(28-20)24-12-7-5-6-8-13-24/h10-11,15-16H,3-9,12-14H2,1-2H3