5-[(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylidene]-2-[(4-methylphenyl)amino]-1,3-thiazol-4-one

Systemtic Name: 5-[(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methylidene]-2-[(4-methylphenyl)amino]-1,3-thiazol-4-one Openeye Name: 5-[(4-allyloxy-3-bromo-5-methoxy-phenyl)methylene]-2-(4-methylanilino)thiazol-4-one CAS Name: 5-[(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylidene]-2-(4-methylanilino)-4-thiazolone IUPAC Name: 5-[(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylidene]-2-(4-methylanilino)-1,3-thiazol-4-one Traditional Name: 5-(4-allyloxy-3-bromo-5-methoxy-benzylidene)-2-(p-toluidino)-2-thiazolin-4-one Formula: C21H19BrN2O3S MolecularWeight: 459.35616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=O)C(=CC3=CC(=C(C(=C3)Br)OCC=C)OC)S2

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=O)C(=CC3=CC(=C(C(=C3)Br)OCC=C)OC)S2

InChI

InChI=1S/C21H19BrN2O3S/c1-4-9-27-19-16(22)10-14(11-17(19)26-3)12-18-20(25)24-21(28-18)23-15-7-5-13(2)6-8-15/h4-8,10-12H,1,9H2,2-3H3,(H,23,24,25)