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

Systemtic Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-methyl-4-nitro-benzamide Openeye Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-methyl-4-nitro-benzamide CAS Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-methyl-4-nitrobenzamide IUPAC Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-methyl-4-nitrobenzamide Traditional Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-3-methyl-4-nitro-benzamide Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C17H15N3O3S/c1-9-4-7-14-15(11(9)3)18-17(24-14)19-16(21)12-5-6-13(20(22)23)10(2)8-12/h4-8H,1-3H3,(H,18,19,21)