2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-ethyl-6-methyl-pyrimidin-4-amine

Systemtic Name: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-ethyl-6-methyl-pyrimidin-4-amine Openeye Name: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-ethyl-6-methyl-pyrimidin-4-amine CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-ethyl-6-methyl-4-pyrimidinamine IUPAC Name: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-ethyl-6-methylpyrimidin-4-amine Traditional Name: [2-[4-(4-chlorophenyl)sulfonylpiperazino]-6-methyl-pyrimidin-4-yl]-ethyl-amine Formula: C17H22ClN5O2S MolecularWeight: 395.90688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22ClN5O2S/c1-3-19-16-12-13(2)20-17(21-16)22-8-10-23(11-9-22)26(24,25)15-6-4-14(18)5-7-15/h4-7,12H,3,8-11H2,1-2H3,(H,19,20,21)