2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-(4-methoxyphenyl)-6-methyl-pyrimidin-4-amine

Systemtic Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-(4-methoxyphenyl)-6-methyl-pyrimidin-4-amine Openeye Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-(4-methoxyphenyl)-6-methyl-pyrimidin-4-amine CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-N-(4-methoxyphenyl)-6-methyl-4-pyrimidinamine IUPAC Name: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-(4-methoxyphenyl)-6-methylpyrimidin-4-amine Traditional Name: [2-(4-brosylpiperazino)-6-methyl-pyrimidin-4-yl]-(4-methoxyphenyl)amine Formula: C22H24BrN5O3S MolecularWeight: 518.42666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H24BrN5O3S/c1-16-15-21(25-18-5-7-19(31-2)8-6-18)26-22(24-16)27-11-13-28(14-12-27)32(29,30)20-9-3-17(23)4-10-20/h3-10,15H,11-14H2,1-2H3,(H,24,25,26)