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

Systemtic Name: N-[4-(4-methoxy-3-nitro-phenyl)-5-methyl-1,3-thiazol-2-yl]-3-nitro-benzamide Openeye Name: N-[4-(4-methoxy-3-nitro-phenyl)-5-methyl-thiazol-2-yl]-3-nitro-benzamide CAS Name: N-[4-(4-methoxy-3-nitrophenyl)-5-methyl-2-thiazolyl]-3-nitrobenzamide IUPAC Name: N-[4-(4-methoxy-3-nitrophenyl)-5-methyl-1,3-thiazol-2-yl]-3-nitrobenzamide Traditional Name: N-[4-(4-methoxy-3-nitro-phenyl)-5-methyl-thiazol-2-yl]-3-nitro-benzamide Formula: C18H14N4O6S MolecularWeight: 414.39196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

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