N-[[5-azanyl-4-cyano-3-(4-fluorophenyl)-2,3-dihydrothiophen-2-yl]carbonyl]pyrrolidine-1-carboxamide

Systemtic Name: N-[[5-azanyl-4-cyano-3-(4-fluorophenyl)-2,3-dihydrothiophen-2-yl]carbonyl]pyrrolidine-1-carboxamide Openeye Name: N-[5-amino-4-cyano-3-(4-fluorophenyl)-2,3-dihydrothiophene-2-carbonyl]pyrrolidine-1-carboxamide CAS Name: N-[[5-amino-4-cyano-3-(4-fluorophenyl)-2,3-dihydrothiophen-2-yl]-oxomethyl]-1-pyrrolidinecarboxamide IUPAC Name: N-[5-amino-4-cyano-3-(4-fluorophenyl)-2,3-dihydrothiophene-2-carbonyl]pyrrolidine-1-carboxamide Traditional Name: N-[5-amino-4-cyano-3-(4-fluorophenyl)-2,3-dihydrothiophene-2-carbonyl]pyrrolidine-1-carboxamide Formula: C17H17FN4O2S MolecularWeight: 360.405883

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)NC(=O)C2C(C(=C(S2)N)C#N)C3=CC=C(C=C3)F

Isomeric SMILES

C1CCN(C1)C(=O)NC(=O)C2C(C(=C(S2)N)C#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H17FN4O2S/c18-11-5-3-10(4-6-11)13-12(9-19)15(20)25-14(13)16(23)21-17(24)22-7-1-2-8-22/h3-6,13-14H,1-2,7-8,20H2,(H,21,23,24)