7-(4-methylsulfonylphenyl)-N-(4-piperazin-1-ylphenyl)pyrrolo[2,3-d]pyrimidin-2-amine

Systemtic Name: 7-(4-methylsulfonylphenyl)-N-(4-piperazin-1-ylphenyl)pyrrolo[2,3-d]pyrimidin-2-amine Openeye Name: 7-(4-methylsulfonylphenyl)-N-(4-piperazin-1-ylphenyl)pyrrolo[2,3-d]pyrimidin-2-amine CAS Name: 7-(4-methylsulfonylphenyl)-N-[4-(1-piperazinyl)phenyl]-2-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 7-(4-methylsulfonylphenyl)-N-(4-piperazin-1-ylphenyl)pyrrolo[2,3-d]pyrimidin-2-amine Traditional Name: [7-(4-mesylphenyl)pyrrolo[2,3-d]pyrimidin-2-yl]-(4-piperazinophenyl)amine Formula: C23H24N6O2S MolecularWeight: 448.54066

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C=CC3=CN=C(N=C32)NC4=CC=C(C=C4)N5CCNCC5

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C=CC3=CN=C(N=C32)NC4=CC=C(C=C4)N5CCNCC5

InChI

InChI=1S/C23H24N6O2S/c1-32(30,31)21-8-6-20(7-9-21)29-13-10-17-16-25-23(27-22(17)29)26-18-2-4-19(5-3-18)28-14-11-24-12-15-28/h2-10,13,16,24H,11-12,14-15H2,1H3,(H,25,26,27)