4-(4-methylsulfonylphenyl)-5-[4-(2-oxidanylideneethylamino)phenyl]thiophene-2-carbonitrile

Systemtic Name: 4-(4-methylsulfonylphenyl)-5-[4-(2-oxidanylideneethylamino)phenyl]thiophene-2-carbonitrile Openeye Name: 4-(4-methylsulfonylphenyl)-5-[4-(2-oxoethylamino)phenyl]thiophene-2-carbonitrile CAS Name: 4-(4-methylsulfonylphenyl)-5-[4-(2-oxoethylamino)phenyl]-2-thiophenecarbonitrile IUPAC Name: 4-(4-methylsulfonylphenyl)-5-[4-(2-oxoethylamino)phenyl]thiophene-2-carbonitrile Traditional Name: 5-[4-(2-ketoethylamino)phenyl]-4-(4-mesylphenyl)thiophene-2-carbonitrile Formula: C20H16N2O3S2 MolecularWeight: 396.48264

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(SC(=C2)C#N)C3=CC=C(C=C3)NCC=O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(SC(=C2)C#N)C3=CC=C(C=C3)NCC=O

InChI

InChI=1S/C20H16N2O3S2/c1-27(24,25)18-8-4-14(5-9-18)19-12-17(13-21)26-20(19)15-2-6-16(7-3-15)22-10-11-23/h2-9,11-12,22H,10H2,1H3