4-[6-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]pyrimidin-4-yl]morpholine

Systemtic Name: 4-[6-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]pyrimidin-4-yl]morpholine Openeye Name: 4-[6-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]pyrimidin-4-yl]morpholine CAS Name: 4-[6-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-4-pyrimidinyl]morpholine IUPAC Name: 4-[6-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]pyrimidin-4-yl]morpholine Traditional Name: 4-[6-[4-(4-tert-butylphenyl)sulfonylpiperazino]pyrimidin-4-yl]morpholine Formula: C22H31N5O3S MolecularWeight: 445.57824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=NC=N3)N4CCOCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=NC=N3)N4CCOCC4

InChI

InChI=1S/C22H31N5O3S/c1-22(2,3)18-4-6-19(7-5-18)31(28,29)27-10-8-25(9-11-27)20-16-21(24-17-23-20)26-12-14-30-15-13-26/h4-7,16-17H,8-15H2,1-3H3