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

Systemtic Name: N-[2-(4-ethylpiperazin-1-yl)ethyl]-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]ethanamide Openeye Name: N-[2-(4-ethylpiperazin-1-yl)ethyl]-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]acetamide CAS Name: N-[2-(4-ethyl-1-piperazinyl)ethyl]-2-[[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methylsulfinyl]acetamide IUPAC Name: N-[2-(4-ethylpiperazin-1-yl)ethyl]-2-[(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methylsulfinyl]acetamide Traditional Name: N-[2-(4-ethylpiperazino)ethyl]-2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methylsulfinyl]acetamide Formula: C24H32N6O2S MolecularWeight: 468.61488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N6O2S/c1-2-27-14-16-28(17-15-27)13-10-25-23(31)20-33(32)19-21-18-26-30(22-8-4-3-5-9-22)24(21)29-11-6-7-12-29/h3-9,11-12,18H,2,10,13-17,19-20H2,1H3,(H,25,31)