ethyl 2-[(4-bromanyl-3,5-dimethoxy-phenyl)carbonylamino]-4-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(4-bromanyl-3,5-dimethoxy-phenyl)carbonylamino]-4-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(4-bromo-3,5-dimethoxy-benzoyl)amino]-4-phenyl-thiazole-5-carboxylate CAS Name: 2-[[(4-bromo-3,5-dimethoxyphenyl)-oxomethyl]amino]-4-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-bromo-3,5-dimethoxybenzoyl)amino]-4-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(4-bromo-3,5-dimethoxy-benzoyl)amino]-4-phenyl-thiazole-5-carboxylic acid ethyl ester Formula: C21H19BrN2O5S MolecularWeight: 491.35496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC(=C(C(=C2)OC)Br)OC)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC(=C(C(=C2)OC)Br)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H19BrN2O5S/c1-4-29-20(26)18-17(12-8-6-5-7-9-12)23-21(30-18)24-19(25)13-10-14(27-2)16(22)15(11-13)28-3/h5-11H,4H2,1-3H3,(H,23,24,25)