3-chloranyl-N-[2-(4-chloranyl-2-nitro-phenyl)sulfanylphenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-(4-chloranyl-2-nitro-phenyl)sulfanylphenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(4-chloro-2-nitro-phenyl)sulfanylphenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[(4-chloro-2-nitrophenyl)thio]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(4-chloro-2-nitrophenyl)sulfanylphenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-[(4-chloro-2-nitro-phenyl)thio]phenyl]benzothiophene-2-carboxamide Formula: C21H12Cl2N2O3S2 MolecularWeight: 475.36758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=CC=CC=C3SC4=C(C=C(C=C4)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=CC=CC=C3SC4=C(C=C(C=C4)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H12Cl2N2O3S2/c22-12-9-10-18(15(11-12)25(27)28)29-17-8-4-2-6-14(17)24-21(26)20-19(23)13-5-1-3-7-16(13)30-20/h1-11H,(H,24,26)