N-(7-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-2-nitro-benzamide

Systemtic Name: N-(7-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-2-nitro-benzamide Openeye Name: N-(7-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-2-nitro-benzamide CAS Name: N-(7-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-2-nitrobenzamide IUPAC Name: N-(7-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-2-nitrobenzamide Traditional Name: N-(7-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-2-nitro-benzamide Formula: C16H12ClN3O3S MolecularWeight: 361.80278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=NC(=O)C3=CC=CC=C3[N+](=O)[O-])N2C

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=NC(=O)C3=CC=CC=C3[N+](=O)[O-])N2C

InChI

InChI=1S/C16H12ClN3O3S/c1-9-7-8-11(17)14-13(9)19(2)16(24-14)18-15(21)10-5-3-4-6-12(10)20(22)23/h3-8H,1-2H3