4-ethoxy-5-methoxy-N-(4-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide

Systemtic Name: 4-ethoxy-5-methoxy-N-(4-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide Openeye Name: 4-ethoxy-5-methoxy-N-(4-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide CAS Name: 4-ethoxy-5-methoxy-N-(4-methyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide IUPAC Name: 4-ethoxy-5-methoxy-N-(4-methyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide Traditional Name: 4-ethoxy-5-methoxy-N-(4-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=NC3=C(C=CC=C3S2)C)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=NC3=C(C=CC=C3S2)C)OC

InChI

InChI=1S/C18H17N3O5S/c1-4-26-14-9-12(21(23)24)11(8-13(14)25-3)17(22)20-18-19-16-10(2)6-5-7-15(16)27-18/h5-9H,4H2,1-3H3,(H,19,20,22)