methyl 3-[[4-azanyl-5-(4-bromophenyl)carbonyl-1,3-thiazol-2-yl]amino]benzoate

Systemtic Name: methyl 3-[[4-azanyl-5-(4-bromophenyl)carbonyl-1,3-thiazol-2-yl]amino]benzoate Openeye Name: methyl 3-[[4-amino-5-(4-bromobenzoyl)thiazol-2-yl]amino]benzoate CAS Name: 3-[[4-amino-5-[(4-bromophenyl)-oxomethyl]-2-thiazolyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-amino-5-(4-bromobenzoyl)-1,3-thiazol-2-yl]amino]benzoate Traditional Name: 3-[[4-amino-5-(4-bromobenzoyl)thiazol-2-yl]amino]benzoic acid methyl ester Formula: C18H14BrN3O3S MolecularWeight: 432.29106

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC2=NC(=C(S2)C(=O)C3=CC=C(C=C3)Br)N

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC2=NC(=C(S2)C(=O)C3=CC=C(C=C3)Br)N

InChI

InChI=1S/C18H14BrN3O3S/c1-25-17(24)11-3-2-4-13(9-11)21-18-22-16(20)15(26-18)14(23)10-5-7-12(19)8-6-10/h2-9H,20H2,1H3,(H,21,22)