(2R)-2-(3-chloranyl-4-cyclopropylsulfonyl-phenyl)-3-(oxan-4-yl)-N-pyrimidin-4-yl-propanamide

Systemtic Name: (2R)-2-(3-chloranyl-4-cyclopropylsulfonyl-phenyl)-3-(oxan-4-yl)-N-pyrimidin-4-yl-propanamide Openeye Name: (2R)-2-(3-chloro-4-cyclopropylsulfonyl-phenyl)-N-pyrimidin-4-yl-3-tetrahydropyran-4-yl-propanamide CAS Name: (2R)-2-(3-chloro-4-cyclopropylsulfonylphenyl)-3-(4-oxanyl)-N-(4-pyrimidinyl)propanamide IUPAC Name: (2R)-2-(3-chloro-4-cyclopropylsulfonylphenyl)-3-(oxan-4-yl)-N-pyrimidin-4-ylpropanamide Traditional Name: (2R)-2-(3-chloro-4-cyclopropylsulfonyl-phenyl)-N-(4-pyrimidyl)-3-tetrahydropyran-4-yl-propionamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1S(=O)(=O)C2=C(C=C(C=C2)C(CC3CCOCC3)C(=O)NC4=NC=NC=C4)Cl

Isomeric SMILES

C1CC1S(=O)(=O)C2=C(C=C(C=C2)[C@@H](CC3CCOCC3)C(=O)NC4=NC=NC=C4)Cl

InChI

InChI=1S/C21H24ClN3O4S/c22-18-12-15(1-4-19(18)30(27,28)16-2-3-16)17(11-14-6-9-29-10-7-14)21(26)25-20-5-8-23-13-24-20/h1,4-5,8,12-14,16-17H,2-3,6-7,9-11H2,(H,23,24,25,26)/t17-/m1/s1