4-[6-[4-(4-chloranyl-2,5-dimethyl-phenyl)sulfonylpiperazin-1-yl]pyrimidin-4-yl]morpholine

Systemtic Name: 4-[6-[4-(4-chloranyl-2,5-dimethyl-phenyl)sulfonylpiperazin-1-yl]pyrimidin-4-yl]morpholine Openeye Name: 4-[6-[4-(4-chloro-2,5-dimethyl-phenyl)sulfonylpiperazin-1-yl]pyrimidin-4-yl]morpholine CAS Name: 4-[6-[4-(4-chloro-2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-4-pyrimidinyl]morpholine IUPAC Name: 4-[6-[4-(4-chloro-2,5-dimethylphenyl)sulfonylpiperazin-1-yl]pyrimidin-4-yl]morpholine Traditional Name: 4-[6-[4-(4-chloro-2,5-dimethyl-phenyl)sulfonylpiperazino]pyrimidin-4-yl]morpholine Formula: C20H26ClN5O3S MolecularWeight: 451.97014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N2CCN(CC2)C3=CC(=NC=N3)N4CCOCC4

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N2CCN(CC2)C3=CC(=NC=N3)N4CCOCC4

InChI

InChI=1S/C20H26ClN5O3S/c1-15-12-18(16(2)11-17(15)21)30(27,28)26-5-3-24(4-6-26)19-13-20(23-14-22-19)25-7-9-29-10-8-25/h11-14H,3-10H2,1-2H3