N-(6-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(6-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-5-nitro-benzothiophene-2-carboxamide Formula: C18H12ClN3O3S2 MolecularWeight: 417.88918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N(C(=NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])S2)C)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N(C(=NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])S2)C)Cl

InChI

InChI=1S/C18H12ClN3O3S2/c1-9-5-11(19)8-14-16(9)21(2)18(27-14)20-17(23)15-7-10-6-12(22(24)25)3-4-13(10)26-15/h3-8H,1-2H3