N-[3-[(3R)-2-butanoyl-3-(furan-2-yl)-3,4-dihydropyrazol-5-yl]phenyl]ethanesulfonamide

Systemtic Name: N-[3-[(3R)-2-butanoyl-3-(furan-2-yl)-3,4-dihydropyrazol-5-yl]phenyl]ethanesulfonamide Openeye Name: N-[3-[(3R)-2-butanoyl-3-(2-furyl)-3,4-dihydropyrazol-5-yl]phenyl]ethanesulfonamide CAS Name: N-[3-[(3R)-3-(2-furanyl)-2-(1-oxobutyl)-3,4-dihydropyrazol-5-yl]phenyl]ethanesulfonamide IUPAC Name: N-[3-[(3R)-2-butanoyl-3-(furan-2-yl)-3,4-dihydropyrazol-5-yl]phenyl]ethanesulfonamide Traditional Name: N-[3-[(5R)-1-butyryl-5-(2-furyl)-2-pyrazolin-3-yl]phenyl]ethanesulfonamide Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(CC(=N1)C2=CC(=CC=C2)NS(=O)(=O)CC)C3=CC=CO3

Isomeric SMILES

CCCC(=O)N1[C@H](CC(=N1)C2=CC(=CC=C2)NS(=O)(=O)CC)C3=CC=CO3

InChI

InChI=1S/C19H23N3O4S/c1-3-7-19(23)22-17(18-10-6-11-26-18)13-16(20-22)14-8-5-9-15(12-14)21-27(24,25)4-2/h5-6,8-12,17,21H,3-4,7,13H2,1-2H3/t17-/m1/s1