N-(3-pyrazol-1-ylphenyl)-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(3-pyrazol-1-ylphenyl)-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(3-pyrazol-1-ylphenyl)-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-[3-(1-pyrazolyl)phenyl]-1-thiophen-2-ylsulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(3-pyrazol-1-ylphenyl)-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: N-(3-pyrazol-1-ylphenyl)-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide Formula: C18H18N4O3S2 MolecularWeight: 402.49052

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=CC=CC(=C3)N4C=CC=N4

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=CC=CC(=C3)N4C=CC=N4

InChI

InChI=1S/C18H18N4O3S2/c23-18(20-14-5-1-6-15(13-14)21-10-4-9-19-21)16-7-2-11-22(16)27(24,25)17-8-3-12-26-17/h1,3-6,8-10,12-13,16H,2,7,11H2,(H,20,23)