(5E)-5-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-2-[(3-chloranyl-4-methyl-phenyl)amino]-1,3-thiazol-4-one

Systemtic Name: (5E)-5-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-2-[(3-chloranyl-4-methyl-phenyl)amino]-1,3-thiazol-4-one Openeye Name: (5E)-5-[(3-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)methylene]-2-(3-chloro-4-methyl-anilino)thiazol-4-one CAS Name: (5E)-5-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-2-(3-chloro-4-methylanilino)-4-thiazolone IUPAC Name: (5E)-5-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-2-(3-chloro-4-methylanilino)-1,3-thiazol-4-one Traditional Name: (5E)-5-(3-bromo-5-methoxy-4-propargyloxy-benzylidene)-2-(3-chloro-4-methyl-anilino)-2-thiazolin-4-one Formula: C21H16BrClN2O3S MolecularWeight: 491.78534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC(=O)/C(=C\C3=CC(=C(C(=C3)Br)OCC#C)OC)/S2)Cl

InChI

InChI=1S/C21H16BrClN2O3S/c1-4-7-28-19-15(22)8-13(9-17(19)27-3)10-18-20(26)25-21(29-18)24-14-6-5-12(2)16(23)11-14/h1,5-6,8-11H,7H2,2-3H3,(H,24,25,26)/b18-10+