2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[[1-(4-ethoxyphenyl)-2-benzimidazolyl]thio]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(1-p-phenetylbenzimidazol-2-yl)thio]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C25H26N6O2S MolecularWeight: 474.57794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C25H26N6O2S/c1-2-33-20-10-8-19(9-11-20)31-22-7-4-3-6-21(22)28-25(31)34-18-23(32)29-14-16-30(17-15-29)24-26-12-5-13-27-24/h3-13H,2,14-18H2,1H3