N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-4-(methylamino)-3-nitro-benzamide

Systemtic Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-4-(methylamino)-3-nitro-benzamide Openeye Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-4-(methylamino)-3-nitro-benzamide CAS Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-4-(methylamino)-3-nitrobenzamide IUPAC Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-4-(methylamino)-3-nitrobenzamide Traditional Name: N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-4-(methylamino)-3-nitro-benzamide Formula: C17H16N4O5S MolecularWeight: 388.39774

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NC2=NC3=CC(=C(C=C3S2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NC2=NC3=CC(=C(C=C3S2)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O5S/c1-18-10-5-4-9(6-12(10)21(23)24)16(22)20-17-19-11-7-13(25-2)14(26-3)8-15(11)27-17/h4-8,18H,1-3H3,(H,19,20,22)