4-(5-chloranyl-7-methyl-1-propyl-pyrrolo[3,2-b]pyridin-3-yl)-N-(3-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine

Systemtic Name: 4-(5-chloranyl-7-methyl-1-propyl-pyrrolo[3,2-b]pyridin-3-yl)-N-(3-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine Openeye Name: 4-(5-chloro-7-methyl-1-propyl-pyrrolo[3,2-b]pyridin-3-yl)-N-(3-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine CAS Name: 4-(5-chloro-7-methyl-1-propyl-3-pyrrolo[3,2-b]pyridinyl)-N-[3-(1-piperazinylsulfonyl)phenyl]-2-pyrimidinamine IUPAC Name: 4-(5-chloro-7-methyl-1-propylpyrrolo[3,2-b]pyridin-3-yl)-N-(3-piperazin-1-ylsulfonylphenyl)pyrimidin-2-amine Traditional Name: [4-(5-chloro-7-methyl-1-propyl-pyrrolo[3,2-b]pyridin-3-yl)pyrimidin-2-yl]-(3-piperazinosulfonylphenyl)amine Formula: C25H28ClN7O2S MolecularWeight: 526.05352

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C2=C1C(=CC(=N2)Cl)C)C3=NC(=NC=C3)NC4=CC(=CC=C4)S(=O)(=O)N5CCNCC5

Isomeric SMILES

CCCN1C=C(C2=C1C(=CC(=N2)Cl)C)C3=NC(=NC=C3)NC4=CC(=CC=C4)S(=O)(=O)N5CCNCC5

InChI

InChI=1S/C25H28ClN7O2S/c1-3-11-32-16-20(23-24(32)17(2)14-22(26)31-23)21-7-8-28-25(30-21)29-18-5-4-6-19(15-18)36(34,35)33-12-9-27-10-13-33/h4-8,14-16,27H,3,9-13H2,1-2H3,(H,28,29,30)