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

Systemtic Name: 2-(dimethylamino)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-nitro-benzamide Openeye Name: 2-(dimethylamino)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-nitro-benzamide CAS Name: 2-(dimethylamino)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-nitrobenzamide IUPAC Name: 2-(dimethylamino)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-nitrobenzamide Traditional Name: 2-(dimethylamino)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-nitro-benzamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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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-])N(C)C

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O4S/c1-4-26-12-6-7-14-16(10-12)27-18(19-14)20-17(23)13-9-11(22(24)25)5-8-15(13)21(2)3/h5-10H,4H2,1-3H3,(H,19,20,23)