4-[2-methyl-3-(oxan-4-yl)imidazol-4-yl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine

Systemtic Name: 4-[2-methyl-3-(oxan-4-yl)imidazol-4-yl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine Openeye Name: N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]-4-(2-methyl-3-tetrahydropyran-4-yl-imidazol-4-yl)pyrimidin-2-amine CAS Name: 4-[2-methyl-3-(4-oxanyl)-4-imidazolyl]-N-[3-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-2-pyrimidinamine IUPAC Name: 4-[2-methyl-3-(oxan-4-yl)imidazol-4-yl]-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrimidin-2-amine Traditional Name: [3-(4-methylpiperazino)sulfonylphenyl]-[4-(2-methyl-3-tetrahydropyran-4-yl-imidazol-4-yl)pyrimidin-2-yl]amine Formula: C24H31N7O3S MolecularWeight: 497.61304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1C2CCOCC2)C3=NC(=NC=C3)NC4=CC(=CC=C4)S(=O)(=O)N5CCN(CC5)C

Isomeric SMILES

CC1=NC=C(N1C2CCOCC2)C3=NC(=NC=C3)NC4=CC(=CC=C4)S(=O)(=O)N5CCN(CC5)C

InChI

InChI=1S/C24H31N7O3S/c1-18-26-17-23(31(18)20-7-14-34-15-8-20)22-6-9-25-24(28-22)27-19-4-3-5-21(16-19)35(32,33)30-12-10-29(2)11-13-30/h3-6,9,16-17,20H,7-8,10-15H2,1-2H3,(H,25,27,28)