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

Systemtic Name: N-(6-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-2-nitro-benzamide Openeye Name: N-(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-2-nitro-benzamide CAS Name: N-(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-2-nitrobenzamide IUPAC Name: N-(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-2-nitrobenzamide Traditional Name: N-(6-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=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/c1-9-7-10(17)8-13-14(9)19(2)16(24-13)18-15(21)11-5-3-4-6-12(11)20(22)23/h3-8H,1-2H3