(2-chloranyl-5-thiomorpholin-4-ylsulfonyl-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (2-chloranyl-5-thiomorpholin-4-ylsulfonyl-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (2-chloro-5-thiomorpholinosulfonyl-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (2-chloro-5-thiomorpholin-4-ylsulfonylphenyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (2-chloro-5-thiomorpholin-4-ylsulfonylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (2-chloro-5-thiomorpholinosulfonyl-phenyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C19H22ClN5O3S2 MolecularWeight: 467.99268

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCSCC4)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCSCC4)Cl

InChI

InChI=1S/C19H22ClN5O3S2/c20-17-3-2-15(30(27,28)25-10-12-29-13-11-25)14-16(17)18(26)23-6-8-24(9-7-23)19-21-4-1-5-22-19/h1-5,14H,6-13H2