N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3,5-dinitro-N-(phenylmethyl)benzamide

Systemtic Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3,5-dinitro-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide CAS Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3,5-dinitro-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3,5-dinitrobenzamide Traditional Name: N-benzyl-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide Formula: C23H18N4O7S MolecularWeight: 494.47662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H18N4O7S/c1-33-18-8-9-19(34-2)21-20(18)24-23(35-21)25(13-14-6-4-3-5-7-14)22(28)15-10-16(26(29)30)12-17(11-15)27(31)32/h3-12H,13H2,1-2H3