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

Systemtic Name: 2-(4-chloranyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanyl-1-[4-(diphenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(4-chloro-6-morpholino-pyrimidin-2-yl)sulfanyl-ethanone CAS Name: 2-[[4-chloro-6-(4-morpholinyl)-2-pyrimidinyl]thio]-1-[4-(diphenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(4-chloro-6-morpholin-4-ylpyrimidin-2-yl)sulfanylethanone Traditional Name: 1-(4-benzhydrylpiperazino)-2-[(4-chloro-6-morpholino-pyrimidin-2-yl)thio]ethanone Formula: C27H30ClN5O2S MolecularWeight: 524.0774

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CSC4=NC(=CC(=N4)Cl)N5CCOCC5

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CSC4=NC(=CC(=N4)Cl)N5CCOCC5

InChI

InChI=1S/C27H30ClN5O2S/c28-23-19-24(31-15-17-35-18-16-31)30-27(29-23)36-20-25(34)32-11-13-33(14-12-32)26(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-10,19,26H,11-18,20H2