[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: [4-(4-methylpiperidin-1-yl)sulfonylphenyl]-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: [4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]methanone CAS Name: [4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [4-(4-methylpiperidin-1-yl)sulfonylphenyl]-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: [4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]-[4-(4-methylpiperidino)sulfonylphenyl]methanone Formula: C25H35N5O3S MolecularWeight: 485.6421

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC(=NC(=C4)C)C(C)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC(=NC(=C4)C)C(C)C

InChI

InChI=1S/C25H35N5O3S/c1-18(2)24-26-20(4)17-23(27-24)28-13-15-29(16-14-28)25(31)21-5-7-22(8-6-21)34(32,33)30-11-9-19(3)10-12-30/h5-8,17-19H,9-16H2,1-4H3