N-[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]-3-methyl-4-nitro-benzamide Openeye Name: N-(4,5-dichloro-1,3-benzothiazol-2-yl)-3-methyl-4-nitro-benzamide CAS Name: N-(4,5-dichloro-1,3-benzothiazol-2-yl)-3-methyl-4-nitrobenzamide IUPAC Name: N-(4,5-dichloro-1,3-benzothiazol-2-yl)-3-methyl-4-nitrobenzamide Traditional Name: N-(4,5-dichloro-1,3-benzothiazol-2-yl)-3-methyl-4-nitro-benzamide Formula: C15H9Cl2N3O3S MolecularWeight: 382.22126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=NC3=C(S2)C=CC(=C3Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=NC3=C(S2)C=CC(=C3Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H9Cl2N3O3S/c1-7-6-8(2-4-10(7)20(22)23)14(21)19-15-18-13-11(24-15)5-3-9(16)12(13)17/h2-6H,1H3,(H,18,19,21)