3,4-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 3,4-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide Openeye Name: 3,4-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide CAS Name: 3,4-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 3,4-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide Traditional Name: 3,4-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C

InChI

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