5-chloranyl-N-[4-[(2S)-2-ethylpiperidin-1-yl]sulfonylphenyl]-2-methylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[4-[(2S)-2-ethylpiperidin-1-yl]sulfonylphenyl]-2-methylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[4-[[(2S)-2-ethyl-1-piperidyl]sulfonyl]phenyl]-2-methylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[4-[[(2S)-2-ethyl-1-piperidinyl]sulfonyl]phenyl]-2-methylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[4-[(2S)-2-ethylpiperidin-1-yl]sulfonylphenyl]-2-methylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[4-[(2S)-2-ethylpiperidino]sulfonylphenyl]-2-mesyl-pyrimidine-4-carboxamide Formula: C19H23ClN4O5S2 MolecularWeight: 486.99272

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NC(=NC=C3Cl)S(=O)(=O)C

Isomeric SMILES

CC[C@H]1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NC(=NC=C3Cl)S(=O)(=O)C

InChI

InChI=1S/C19H23ClN4O5S2/c1-3-14-6-4-5-11-24(14)31(28,29)15-9-7-13(8-10-15)22-18(25)17-16(20)12-21-19(23-17)30(2,26)27/h7-10,12,14H,3-6,11H2,1-2H3,(H,22,25)/t14-/m0/s1