2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[(1-cyclopentyl-4,5-dimethyl-2-imidazolyl)thio]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(1-cyclopentyl-4,5-dimethylimidazol-2-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)thio]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C20H28N6OS MolecularWeight: 400.54092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(=O)N2CCN(CC2)C3=NC=CC=N3)C4CCCC4)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)N2CCN(CC2)C3=NC=CC=N3)C4CCCC4)C

InChI

InChI=1S/C20H28N6OS/c1-15-16(2)26(17-6-3-4-7-17)20(23-15)28-14-18(27)24-10-12-25(13-11-24)19-21-8-5-9-22-19/h5,8-9,17H,3-4,6-7,10-14H2,1-2H3