3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide

Systemtic Name: 3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide Openeye Name: 3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide CAS Name: 3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide IUPAC Name: 3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide Traditional Name: 3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C(=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C(=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O3S/c1-9-6-7-12-13(8-9)23-16(17-12)18-15(20)11-5-3-4-10(2)14(11)19(21)22/h3-8H,1-2H3,(H,17,18,20)