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

Systemtic Name: 2-chloranyl-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-5-nitro-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-chloro-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-5-nitro-benzamide CAS Name: 2-chloro-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-5-nitro-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-chloro-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-5-nitrobenzamide Traditional Name: N-benzyl-2-chloro-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-5-nitro-benzamide Formula: C23H18ClN3O5S MolecularWeight: 483.92412

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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=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C23H18ClN3O5S/c1-31-18-10-11-19(32-2)21-20(18)25-23(33-21)26(13-14-6-4-3-5-7-14)22(28)16-12-15(27(29)30)8-9-17(16)24/h3-12H,13H2,1-2H3