N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(1-phenylpyrazol-4-yl)ethanamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(1-phenylpyrazol-4-yl)ethanamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(1-phenylpyrazol-4-yl)acetamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-2-(1-phenyl-4-pyrazolyl)acetamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-2-(1-phenylpyrazol-4-yl)acetamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-2-(1-phenylpyrazol-4-yl)acetamide Formula: C21H21ClN4O3S MolecularWeight: 444.93444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CC3=CN(N=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CC3=CN(N=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H21ClN4O3S/c22-19-9-8-17(13-20(19)30(28,29)25-10-4-5-11-25)24-21(27)12-16-14-23-26(15-16)18-6-2-1-3-7-18/h1-3,6-9,13-15H,4-5,10-12H2,(H,24,27)