N-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-4-methyl-3,5-dinitro-benzamide

Systemtic Name: N-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-4-methyl-3,5-dinitro-benzamide Openeye Name: N-[4-(3-methoxyphenyl)thiazol-2-yl]-4-methyl-3,5-dinitro-benzamide CAS Name: N-[4-(3-methoxyphenyl)-2-thiazolyl]-4-methyl-3,5-dinitrobenzamide IUPAC Name: N-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-4-methyl-3,5-dinitrobenzamide Traditional Name: N-[4-(3-methoxyphenyl)thiazol-2-yl]-4-methyl-3,5-dinitro-benzamide Formula: C18H14N4O6S MolecularWeight: 414.39196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=NC(=CS2)C3=CC(=CC=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=NC(=CS2)C3=CC(=CC=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H14N4O6S/c1-10-15(21(24)25)7-12(8-16(10)22(26)27)17(23)20-18-19-14(9-29-18)11-4-3-5-13(6-11)28-2/h3-9H,1-2H3,(H,19,20,23)