N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(methylamino)-5-nitro-benzamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(methylamino)-5-nitro-benzamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(methylamino)-5-nitro-benzamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(methylamino)-5-nitrobenzamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(methylamino)-5-nitrobenzamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(methylamino)-5-nitro-benzamide Formula: C17H16N4O4S MolecularWeight: 372.39834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC

InChI

InChI=1S/C17H16N4O4S/c1-3-25-11-5-7-14-15(9-11)26-17(19-14)20-16(22)12-8-10(21(23)24)4-6-13(12)18-2/h4-9,18H,3H2,1-2H3,(H,19,20,22)