2-(5-ethanoyl-2-ethyl-6-methyl-pyrimidin-4-yl)sulfanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(5-ethanoyl-2-ethyl-6-methyl-pyrimidin-4-yl)sulfanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone Openeye Name: 2-(5-acetyl-2-ethyl-6-methyl-pyrimidin-4-yl)sulfanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone CAS Name: 2-[(5-acetyl-2-ethyl-6-methyl-4-pyrimidinyl)thio]-1-[4-(4-methoxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(5-acetyl-2-ethyl-6-methylpyrimidin-4-yl)sulfanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(5-acetyl-2-ethyl-6-methyl-pyrimidin-4-yl)thio]-1-[4-(4-methoxyphenyl)piperazino]ethanone Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC)C(=O)C)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC)C(=O)C)C

InChI

InChI=1S/C22H28N4O3S/c1-5-19-23-15(2)21(16(3)27)22(24-19)30-14-20(28)26-12-10-25(11-13-26)17-6-8-18(29-4)9-7-17/h6-9H,5,10-14H2,1-4H3