ethyl 2-[3-(3-bromanyl-4-methoxy-phenyl)prop-2-enoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[3-(3-bromanyl-4-methoxy-phenyl)prop-2-enoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[3-(3-bromo-4-methoxy-phenyl)prop-2-enoylamino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[3-(3-bromo-4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(3-bromo-4-methoxyphenyl)prop-2-enoylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[3-(3-bromo-4-methoxy-phenyl)acryloyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C17H17BrN2O4S MolecularWeight: 425.29688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C=CC2=CC(=C(C=C2)OC)Br)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C=CC2=CC(=C(C=C2)OC)Br)C

InChI

InChI=1S/C17H17BrN2O4S/c1-4-24-16(22)15-10(2)19-17(25-15)20-14(21)8-6-11-5-7-13(23-3)12(18)9-11/h5-9H,4H2,1-3H3,(H,19,20,21)