1-(2-chloranylpyridin-3-yl)sulfonyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-(2-chloranylpyridin-3-yl)sulfonyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]piperidine-4-carboxamide Openeye Name: 1-[(2-chloro-3-pyridyl)sulfonyl]-N-[[4-(isopropylcarbamoylamino)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-[(2-chloro-3-pyridinyl)sulfonyl]-N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-chloropyridin-3-yl)sulfonyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-[(2-chloro-3-pyridyl)sulfonyl]-N-[4-(isopropylcarbamoylamino)benzyl]isonipecotamide Formula: C22H28ClN5O4S MolecularWeight: 494.00682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C22H28ClN5O4S/c1-15(2)26-22(30)27-18-7-5-16(6-8-18)14-25-21(29)17-9-12-28(13-10-17)33(31,32)19-4-3-11-24-20(19)23/h3-8,11,15,17H,9-10,12-14H2,1-2H3,(H,25,29)(H2,26,27,30)