methyl 3-[2-[(4-bromophenyl)amino]-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]propanoate

Systemtic Name: methyl 3-[2-[(4-bromophenyl)amino]-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]propanoate Openeye Name: methyl 3-[2-(4-bromoanilino)-4-(4-methoxyphenyl)thiazol-5-yl]propanoate CAS Name: 3-[2-(4-bromoanilino)-4-(4-methoxyphenyl)-5-thiazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(4-bromoanilino)-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]propanoate Traditional Name: 3-[2-(4-bromoanilino)-4-(4-methoxyphenyl)thiazol-5-yl]propionic acid methyl ester Formula: C20H19BrN2O3S MolecularWeight: 447.34546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(SC(=N2)NC3=CC=C(C=C3)Br)CCC(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(SC(=N2)NC3=CC=C(C=C3)Br)CCC(=O)OC

InChI

InChI=1S/C20H19BrN2O3S/c1-25-16-9-3-13(4-10-16)19-17(11-12-18(24)26-2)27-20(23-19)22-15-7-5-14(21)6-8-15/h3-10H,11-12H2,1-2H3,(H,22,23)