N-[4-(1,3-benzothiazol-2-yl)-3-chloranyl-phenyl]-3-chloranyl-7-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-3-chloranyl-phenyl]-3-chloranyl-7-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)-3-chloro-phenyl]-3-chloro-7-nitro-benzothiophene-2-carboxamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]-3-chloro-7-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]-3-chloro-7-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)-3-chloro-phenyl]-3-chloro-7-nitro-benzothiophene-2-carboxamide Formula: C22H11Cl2N3O3S2 MolecularWeight: 500.37704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=C(C=C(C=C3)NC(=O)C4=C(C5=C(S4)C(=CC=C5)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=C(C=C(C=C3)NC(=O)C4=C(C5=C(S4)C(=CC=C5)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C22H11Cl2N3O3S2/c23-14-10-11(8-9-12(14)22-26-15-5-1-2-7-17(15)31-22)25-21(28)20-18(24)13-4-3-6-16(27(29)30)19(13)32-20/h1-10H,(H,25,28)