N-[4-(3-bromanyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-[4-(3-bromanyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-[4-(3-bromo-4-methoxy-phenyl)thiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-[4-(3-bromo-4-methoxyphenyl)-2-thiazolyl]-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-[4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2-yl]-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-[4-(3-bromo-4-methoxy-phenyl)thiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide Formula: C19H16BrN3O6S MolecularWeight: 494.31584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)Br

InChI

InChI=1S/C19H16BrN3O6S/c1-27-15-5-4-10(6-12(15)20)13-9-30-19(21-13)22-18(24)11-7-16(28-2)17(29-3)8-14(11)23(25)26/h4-9H,1-3H3,(H,21,22,24)