(4-propan-2-ylsulfonylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (4-propan-2-ylsulfonylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (4-isopropylsulfonylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (4-propan-2-ylsulfonylphenyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (4-propan-2-ylsulfonylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (4-isopropylsulfonylphenyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O3S/c1-14(2)26(24,25)16-6-4-15(5-7-16)17(23)21-10-12-22(13-11-21)18-19-8-3-9-20-18/h3-9,14H,10-13H2,1-2H3