1-[2-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3H-benzimidazol-5-yl]-3-(2-chlorophenyl)urea

Systemtic Name: 1-[2-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3H-benzimidazol-5-yl]-3-(2-chlorophenyl)urea Openeye Name: 1-[2-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3H-benzimidazol-5-yl]-3-(2-chlorophenyl)urea CAS Name: 1-[2-(4-amino-7-cyclopentyl-5-pyrrolo[2,3-d]pyrimidinyl)-3H-benzimidazol-5-yl]-3-(2-chlorophenyl)urea IUPAC Name: 1-[2-(4-amino-7-cyclopentylpyrrolo[2,3-d]pyrimidin-5-yl)-3H-benzimidazol-5-yl]-3-(2-chlorophenyl)urea Traditional Name: 1-[2-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3H-benzimidazol-5-yl]-3-(2-chlorophenyl)urea Formula: C25H23ClN8O MolecularWeight: 486.95612

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C4=NC5=C(N4)C=C(C=C5)NC(=O)NC6=CC=CC=C6Cl

Isomeric SMILES

C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C4=NC5=C(N4)C=C(C=C5)NC(=O)NC6=CC=CC=C6Cl

InChI

InChI=1S/C25H23ClN8O/c26-17-7-3-4-8-18(17)33-25(35)30-14-9-10-19-20(11-14)32-23(31-19)16-12-34(15-5-1-2-6-15)24-21(16)22(27)28-13-29-24/h3-4,7-13,15H,1-2,5-6H2,(H,31,32)(H2,27,28,29)(H2,30,33,35)