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

Systemtic Name: 5-chloranyl-2-ethylsulfanyl-N-[4-[(2R)-2-methylpiperidin-1-yl]sulfonylphenyl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-ethylsulfanyl-N-[4-[[(2R)-2-methyl-1-piperidyl]sulfonyl]phenyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(ethylthio)-N-[4-[[(2R)-2-methyl-1-piperidinyl]sulfonyl]phenyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-ethylsulfanyl-N-[4-[(2R)-2-methylpiperidin-1-yl]sulfonylphenyl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(ethylthio)-N-[4-[(2R)-2-methylpiperidino]sulfonylphenyl]pyrimidine-4-carboxamide Formula: C19H23ClN4O3S2 MolecularWeight: 454.99392

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3C)Cl

Isomeric SMILES

CCSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC[C@H]3C)Cl

InChI

InChI=1S/C19H23ClN4O3S2/c1-3-28-19-21-12-16(20)17(23-19)18(25)22-14-7-9-15(10-8-14)29(26,27)24-11-5-4-6-13(24)2/h7-10,12-13H,3-6,11H2,1-2H3,(H,22,25)/t13-/m1/s1