N-[3-[(3S)-3-(4-dimethylaminophenyl)-2-ethylsulfonyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide

Systemtic Name: N-[3-[(3S)-3-(4-dimethylaminophenyl)-2-ethylsulfonyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide Openeye Name: N-[3-[(3S)-3-(4-dimethylaminophenyl)-2-ethylsulfonyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide CAS Name: N-[3-[(3S)-3-(4-dimethylaminophenyl)-2-ethylsulfonyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide IUPAC Name: N-[3-[(3S)-3-(4-dimethylaminophenyl)-2-ethylsulfonyl-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide Traditional Name: N-[3-[(5S)-5-(4-dimethylaminophenyl)-1-esyl-2-pyrazolin-3-yl]phenyl]methanesulfonamide Formula: C20H26N4O4S2 MolecularWeight: 450.57484

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C(CC(=N1)C2=CC(=CC=C2)NS(=O)(=O)C)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCS(=O)(=O)N1[C@@H](CC(=N1)C2=CC(=CC=C2)NS(=O)(=O)C)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C20H26N4O4S2/c1-5-30(27,28)24-20(15-9-11-18(12-10-15)23(2)3)14-19(21-24)16-7-6-8-17(13-16)22-29(4,25)26/h6-13,20,22H,5,14H2,1-4H3/t20-/m0/s1