Ethanamine, 2-[2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulfonyl]ethoxy]-N,N-dimethyl-, monoformate

CAS Name

Formic acid, compd. with 2-[2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulfonyl]ethoxy]-N,N-dimethylethanamine (1:1)

Molecular Formula

C₂₁H₂₆ClN₃O₃S.CH₂O₂

Other Names and Identifiers

InChI

InChI=1S/C21H26ClN3O3S.CH2O2/c1-24(2)13-14-28-15-16-29(26,27)20-9-7-19(8-10-20)25-12-11-21(23-25)17-3-5-18(22)6-4-17;2-1-3/h3-10H,11-16H2,1-2H3;1H,(H,2,3)

InChIKey

InChIKey=IDBCGDXVDSEEAH-UHFFFAOYSA-N

SMILES

S(CCOCCN(C)C)(=O)(=O)C1=CC=C(N2N=C(CC2)C3=CC=C(Cl)C=C3)C=C1.C(O)=O

Canonical SMILES

O=CO.O=S(=O)(C1=CC=C(C=C1)N2N=C(C=3C=CC(Cl)=CC3)CC2)CCOCCN(C)C

Other Names for this Substance