N-ethyl-6-methyl-2-[4-(phenylsulfonyl)piperazin-1-yl]pyrimidin-4-amine

Systemtic Name: N-ethyl-6-methyl-2-[4-(phenylsulfonyl)piperazin-1-yl]pyrimidin-4-amine Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-ethyl-6-methyl-pyrimidin-4-amine CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-ethyl-6-methyl-4-pyrimidinamine IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-ethyl-6-methylpyrimidin-4-amine Traditional Name: [2-(4-besylpiperazino)-6-methyl-pyrimidin-4-yl]-ethyl-amine Formula: C17H23N5O2S MolecularWeight: 361.46182

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC(=C1)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCNC1=NC(=NC(=C1)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H23N5O2S/c1-3-18-16-13-14(2)19-17(20-16)21-9-11-22(12-10-21)25(23,24)15-7-5-4-6-8-15/h4-8,13H,3,9-12H2,1-2H3,(H,18,19,20)