N-[3-(4-ethylpiperazin-1-yl)propyl]-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]ethanamide

Systemtic Name: N-[3-(4-ethylpiperazin-1-yl)propyl]-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]ethanamide Openeye Name: N-[3-(4-ethylpiperazin-1-yl)propyl]-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]acetamide CAS Name: N-[3-(4-ethyl-1-piperazinyl)propyl]-2-[[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methylsulfinyl]acetamide IUPAC Name: N-[3-(4-ethylpiperazin-1-yl)propyl]-2-[(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methylsulfinyl]acetamide Traditional Name: N-[3-(4-ethylpiperazino)propyl]-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]acetamide Formula: C25H34N6O2S MolecularWeight: 482.64146

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCNC(=O)CS(=O)CC2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

CCN1CCN(CC1)CCCNC(=O)CS(=O)CC2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C25H34N6O2S/c1-2-28-15-17-29(18-16-28)12-8-11-26-24(32)21-34(33)20-22-19-27-31(23-9-4-3-5-10-23)25(22)30-13-6-7-14-30/h3-7,9-10,13-14,19H,2,8,11-12,15-18,20-21H2,1H3,(H,26,32)