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

Systemtic Name: (5E)-5-[(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-2-phenylazanyl-1,3-thiazol-4-one Openeye Name: (5E)-2-anilino-5-[(3-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)methylene]thiazol-4-one CAS Name: (5E)-2-anilino-5-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-4-thiazolone IUPAC Name: (5E)-2-anilino-5-[(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5E)-2-anilino-5-(3-bromo-5-methoxy-4-propargyloxy-benzylidene)-2-thiazolin-4-one Formula: C20H15BrN2O3S MolecularWeight: 443.3137

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)N=C(S2)NC3=CC=CC=C3)Br)OCC#C

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/2\C(=O)N=C(S2)NC3=CC=CC=C3)Br)OCC#C

InChI

InChI=1S/C20H15BrN2O3S/c1-3-9-26-18-15(21)10-13(11-16(18)25-2)12-17-19(24)23-20(27-17)22-14-7-5-4-6-8-14/h1,4-8,10-12H,9H2,2H3,(H,22,23,24)/b17-12+