8-[4-(6-methyl-2-phenyl-5-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]sulfonylquinoline

Systemtic Name: 8-[4-(6-methyl-2-phenyl-5-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]sulfonylquinoline Openeye Name: 8-[4-(5-isopropyl-6-methyl-2-phenyl-pyrimidin-4-yl)piperazin-1-yl]sulfonylquinoline CAS Name: 8-[[4-(6-methyl-2-phenyl-5-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]sulfonyl]quinoline IUPAC Name: 8-[4-(6-methyl-2-phenyl-5-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]sulfonylquinoline Traditional Name: 8-[4-(5-isopropyl-6-methyl-2-phenyl-pyrimidin-4-yl)piperazino]sulfonylquinoline Formula: C27H29N5O2S MolecularWeight: 487.61646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5)C(C)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5)C(C)C

InChI

InChI=1S/C27H29N5O2S/c1-19(2)24-20(3)29-26(22-9-5-4-6-10-22)30-27(24)31-15-17-32(18-16-31)35(33,34)23-13-7-11-21-12-8-14-28-25(21)23/h4-14,19H,15-18H2,1-3H3