diethyl 2-[[4-(bromomethyl)-2-phenyl-1,3-thiazol-5-yl]methylidene]propanedioate

Systemtic Name: diethyl 2-[[4-(bromomethyl)-2-phenyl-1,3-thiazol-5-yl]methylidene]propanedioate Openeye Name: diethyl 2-[[4-(bromomethyl)-2-phenyl-thiazol-5-yl]methylene]propanedioate CAS Name: 2-[[4-(bromomethyl)-2-phenyl-5-thiazolyl]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-(bromomethyl)-2-phenyl-1,3-thiazol-5-yl]methylidene]propanedioate Traditional Name: 2-[[4-(bromomethyl)-2-phenyl-thiazol-5-yl]methylene]malonic acid diethyl ester Formula: C18H18BrNO4S MolecularWeight: 424.30882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(N=C(S1)C2=CC=CC=C2)CBr)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CC1=C(N=C(S1)C2=CC=CC=C2)CBr)C(=O)OCC

InChI

InChI=1S/C18H18BrNO4S/c1-3-23-17(21)13(18(22)24-4-2)10-15-14(11-19)20-16(25-15)12-8-6-5-7-9-12/h5-10H,3-4,11H2,1-2H3