N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2,4-dinitro-benzamide

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2,4-dinitro-benzamide Openeye Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-2,4-dinitro-benzamide CAS Name: N-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-2,4-dinitrobenzamide IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2,4-dinitrobenzamide Traditional Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-2,4-dinitro-benzamide Formula: C18H14N4O7S MolecularWeight: 430.39136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N4O7S/c1-28-15-6-3-10(7-16(15)29-2)13-9-30-18(19-13)20-17(23)12-5-4-11(21(24)25)8-14(12)22(26)27/h3-9H,1-2H3,(H,19,20,23)