N-[(3R,4S)-1-methyl-4-(4-pyrimidin-5-ylphenyl)pyrrolidin-3-yl]propane-2-sulfonamide

Systemtic Name: N-[(3R,4S)-1-methyl-4-(4-pyrimidin-5-ylphenyl)pyrrolidin-3-yl]propane-2-sulfonamide Openeye Name: N-[(3R,4S)-1-methyl-4-(4-pyrimidin-5-ylphenyl)pyrrolidin-3-yl]propane-2-sulfonamide CAS Name: N-[(3R,4S)-1-methyl-4-[4-(5-pyrimidinyl)phenyl]-3-pyrrolidinyl]-2-propanesulfonamide IUPAC Name: N-[(3R,4S)-1-methyl-4-(4-pyrimidin-5-ylphenyl)pyrrolidin-3-yl]propane-2-sulfonamide Traditional Name: N-[(3R,4S)-1-methyl-4-[4-(5-pyrimidyl)phenyl]pyrrolidin-3-yl]propane-2-sulfonamide Formula: C18H24N4O2S MolecularWeight: 360.47376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NC1CN(CC1C2=CC=C(C=C2)C3=CN=CN=C3)C

Isomeric SMILES

CC(C)S(=O)(=O)N[C@H]1CN(C[C@@H]1C2=CC=C(C=C2)C3=CN=CN=C3)C

InChI

InChI=1S/C18H24N4O2S/c1-13(2)25(23,24)21-18-11-22(3)10-17(18)15-6-4-14(5-7-15)16-8-19-12-20-9-16/h4-9,12-13,17-18,21H,10-11H2,1-3H3/t17-,18+/m1/s1