N-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]thiophene-2-carboxamide CAS Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-pyridin-3-ylethyl]thiophene-2-carboxamide Traditional Name: N-[2-(3,4-dimethylphenyl)sulfonyl-2-(3-pyridyl)ethyl]thiophene-2-carboxamide Formula: C20H20N2O3S2 MolecularWeight: 400.5144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C(CNC(=O)C2=CC=CS2)C3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C(CNC(=O)C2=CC=CS2)C3=CN=CC=C3)C

InChI

InChI=1S/C20H20N2O3S2/c1-14-7-8-17(11-15(14)2)27(24,25)19(16-5-3-9-21-12-16)13-22-20(23)18-6-4-10-26-18/h3-12,19H,13H2,1-2H3,(H,22,23)