N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-1-(4-fluorophenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(3-cyano-4,5-dimethylthiophen-2-yl)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C18H18FN3O3S2 MolecularWeight: 407.482223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C18H18FN3O3S2/c1-11-12(2)26-18(15(11)10-20)21-17(23)16-4-3-9-22(16)27(24,25)14-7-5-13(19)6-8-14/h5-8,16H,3-4,9H2,1-2H3,(H,21,23)