N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-nitro-2-phenoxy-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-nitro-2-phenoxy-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-nitro-2-phenoxy-benzamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-nitro-2-phenoxybenzamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-nitro-2-phenoxybenzamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-5-nitro-2-phenoxy-benzamide Formula: C22H17N3O4S MolecularWeight: 419.45308

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC4=CC=CC=C4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC4=CC=CC=C4

InChI

InChI=1S/C22H17N3O4S/c1-24(14-21-23-18-9-5-6-10-20(18)30-21)22(26)17-13-15(25(27)28)11-12-19(17)29-16-7-3-2-4-8-16/h2-13H,14H2,1H3