2-(4-chloranyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-chloranyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-chloro-6-morpholino-pyrimidin-2-yl)sulfanyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone CAS Name: 2-[[4-chloro-6-(4-morpholinyl)-2-pyrimidinyl]thio]-1-[4-(2-methoxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-chloro-6-morpholin-4-ylpyrimidin-2-yl)sulfanyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(4-chloro-6-morpholino-pyrimidin-2-yl)thio]-1-[4-(2-methoxyphenyl)piperazino]ethanone Formula: C21H26ClN5O3S MolecularWeight: 463.98084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=NC(=CC(=N3)Cl)N4CCOCC4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=NC(=CC(=N3)Cl)N4CCOCC4

InChI

InChI=1S/C21H26ClN5O3S/c1-29-17-5-3-2-4-16(17)25-6-8-27(9-7-25)20(28)15-31-21-23-18(22)14-19(24-21)26-10-12-30-13-11-26/h2-5,14H,6-13,15H2,1H3