2-[2-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3-thiazol-4-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[2-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3-thiazol-4-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[2-[2-(4-ethylphenyl)-2-oxo-ethyl]sulfanylthiazol-4-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[2-[[2-(4-ethylphenyl)-2-oxoethyl]thio]-4-thiazolyl]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[2-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-1,3-thiazol-4-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[2-[[2-(4-ethylphenyl)-2-keto-ethyl]thio]thiazol-4-yl]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C23H25N5O2S2 MolecularWeight: 467.6069

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CSC2=NC(=CS2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CSC2=NC(=CS2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C23H25N5O2S2/c1-2-17-4-6-18(7-5-17)20(29)16-32-23-26-19(15-31-23)14-21(30)27-10-12-28(13-11-27)22-24-8-3-9-25-22/h3-9,15H,2,10-14,16H2,1H3