4-chloranyl-6-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]pyrimidin-2-amine

Systemtic Name: 4-chloranyl-6-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]pyrimidin-2-amine Openeye Name: 4-chloro-6-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]pyrimidin-2-amine CAS Name: 4-chloro-6-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-2-pyrimidinamine IUPAC Name: 4-chloro-6-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]pyrimidin-2-amine Traditional Name: [4-chloro-6-[4-(2,5-dimethylphenyl)sulfonylpiperazino]pyrimidin-2-yl]amine Formula: C16H20ClN5O2S MolecularWeight: 381.8803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C3=CC(=NC(=N3)N)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C3=CC(=NC(=N3)N)Cl

InChI

InChI=1S/C16H20ClN5O2S/c1-11-3-4-12(2)13(9-11)25(23,24)22-7-5-21(6-8-22)15-10-14(17)19-16(18)20-15/h3-4,9-10H,5-8H2,1-2H3,(H2,18,19,20)