5-chloranyl-N-[4-[(2R)-2-methylpiperidin-1-yl]sulfonylphenyl]-2-propylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[4-[(2R)-2-methylpiperidin-1-yl]sulfonylphenyl]-2-propylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[4-[[(2R)-2-methyl-1-piperidyl]sulfonyl]phenyl]-2-propylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[4-[[(2R)-2-methyl-1-piperidinyl]sulfonyl]phenyl]-2-(propylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[4-[(2R)-2-methylpiperidin-1-yl]sulfonylphenyl]-2-propylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[4-[(2R)-2-methylpiperidino]sulfonylphenyl]-2-(propylthio)pyrimidine-4-carboxamide Formula: C20H25ClN4O3S2 MolecularWeight: 469.0205

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3C)Cl

Isomeric SMILES

CCCSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC[C@H]3C)Cl

InChI

InChI=1S/C20H25ClN4O3S2/c1-3-12-29-20-22-13-17(21)18(24-20)19(26)23-15-7-9-16(10-8-15)30(27,28)25-11-5-4-6-14(25)2/h7-10,13-14H,3-6,11-12H2,1-2H3,(H,23,26)/t14-/m1/s1