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

Systemtic Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C18H17N3O5S/c1-9-5-6-10(2)16-15(9)19-18(27-16)20-17(22)11-7-13(25-3)14(26-4)8-12(11)21(23)24/h5-8H,1-4H3,(H,19,20,22)