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

Systemtic Name: N-(6-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide Openeye Name: N-(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide CAS Name: N-(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-3-nitrobenzamide IUPAC Name: N-(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-3-nitrobenzamide Traditional Name: N-(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide Formula: C16H12ClN3O3S MolecularWeight: 361.80278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N(C(=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])S2)C)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N(C(=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])S2)C)Cl

InChI

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