N-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]ethanamide

Systemtic Name: N-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]ethanamide Openeye Name: N-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]acetamide CAS Name: N-[2-(1-ethyl-3,5-dimethyl-4-pyrazolyl)ethyl]-2-[[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methylsulfinyl]acetamide IUPAC Name: N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-2-[(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methylsulfinyl]acetamide Traditional Name: N-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]acetamide Formula: C25H30N6O2S MolecularWeight: 478.6097

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CCNC(=O)CS(=O)CC2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CCNC(=O)CS(=O)CC2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4)C

InChI

InChI=1S/C25H30N6O2S/c1-4-30-20(3)23(19(2)28-30)12-13-26-24(32)18-34(33)17-21-16-27-31(22-10-6-5-7-11-22)25(21)29-14-8-9-15-29/h5-11,14-16H,4,12-13,17-18H2,1-3H3,(H,26,32)