5-[2-[bis(4-chlorophenyl)methylsulfonyl]ethanoyl]thiophene-2-carbonitrile

Systemtic Name: 5-[2-[bis(4-chlorophenyl)methylsulfonyl]ethanoyl]thiophene-2-carbonitrile Openeye Name: 5-[2-[bis(4-chlorophenyl)methylsulfonyl]acetyl]thiophene-2-carbonitrile CAS Name: 5-[2-[bis(4-chlorophenyl)methylsulfonyl]-1-oxoethyl]-2-thiophenecarbonitrile IUPAC Name: 5-[2-[bis(4-chlorophenyl)methylsulfonyl]acetyl]thiophene-2-carbonitrile Traditional Name: 5-[2-[bis(4-chlorophenyl)methylsulfonyl]acetyl]thiophene-2-carbonitrile Formula: C20H13Cl2NO3S2 MolecularWeight: 450.35812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)S(=O)(=O)CC(=O)C3=CC=C(S3)C#N)Cl

Isomeric SMILES

C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)S(=O)(=O)CC(=O)C3=CC=C(S3)C#N)Cl

InChI

InChI=1S/C20H13Cl2NO3S2/c21-15-5-1-13(2-6-15)20(14-3-7-16(22)8-4-14)28(25,26)12-18(24)19-10-9-17(11-23)27-19/h1-10,20H,12H2