N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(methylamino)-3-nitro-benzamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(methylamino)-3-nitro-benzamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(methylamino)-3-nitro-benzamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(methylamino)-3-nitrobenzamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(methylamino)-3-nitrobenzamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(methylamino)-3-nitro-benzamide Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O4S/c1-17-11-5-3-9(7-13(11)20(22)23)15(21)19-16-18-12-6-4-10(24-2)8-14(12)25-16/h3-8,17H,1-2H3,(H,18,19,21)