N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-cyclopropylcarbonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-cyclopropylcarbonyl-piperidine-4-carboxamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-(cyclopropanecarbonyl)piperidine-4-carboxamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-1-[cyclopropyl(oxo)methyl]-4-piperidinecarboxamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-1-(cyclopropanecarbonyl)piperidine-4-carboxamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-1-(cyclopropanecarbonyl)isonipecotamide Formula: C20H26ClN3O4S MolecularWeight: 439.95614

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3CCN(CC3)C(=O)C4CC4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3CCN(CC3)C(=O)C4CC4)Cl

InChI

InChI=1S/C20H26ClN3O4S/c21-17-6-5-16(13-18(17)29(27,28)24-9-1-2-10-24)22-19(25)14-7-11-23(12-8-14)20(26)15-3-4-15/h5-6,13-15H,1-4,7-12H2,(H,22,25)