N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-1-(4-fluorophenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-1-(4-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C18H21FN6O3S MolecularWeight: 420.461143

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCCC3=C(C(=NN3)N)C#N

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCCC3=C(C(=NN3)N)C#N

InChI

InChI=1S/C18H21FN6O3S/c19-12-5-7-13(8-6-12)29(27,28)25-10-2-4-16(25)18(26)22-9-1-3-15-14(11-20)17(21)24-23-15/h5-8,16H,1-4,9-10H2,(H,22,26)(H3,21,23,24)