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

Systemtic Name: 1-[2-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3H-benzimidazol-5-yl]-3-(2-ethoxyphenyl)urea Openeye Name: 1-[2-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3H-benzimidazol-5-yl]-3-(2-ethoxyphenyl)urea CAS Name: 1-[2-(4-amino-7-cyclopentyl-5-pyrrolo[2,3-d]pyrimidinyl)-3H-benzimidazol-5-yl]-3-(2-ethoxyphenyl)urea IUPAC Name: 1-[2-(4-amino-7-cyclopentylpyrrolo[2,3-d]pyrimidin-5-yl)-3H-benzimidazol-5-yl]-3-(2-ethoxyphenyl)urea Traditional Name: 1-[2-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3H-benzimidazol-5-yl]-3-o-phenetyl-urea Formula: C27H28N8O2 MolecularWeight: 496.56362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)NC2=CC3=C(C=C2)N=C(N3)C4=CN(C5=C4C(=NC=N5)N)C6CCCC6

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)NC2=CC3=C(C=C2)N=C(N3)C4=CN(C5=C4C(=NC=N5)N)C6CCCC6

InChI

InChI=1S/C27H28N8O2/c1-2-37-22-10-6-5-9-20(22)34-27(36)31-16-11-12-19-21(13-16)33-25(32-19)18-14-35(17-7-3-4-8-17)26-23(18)24(28)29-15-30-26/h5-6,9-15,17H,2-4,7-8H2,1H3,(H,32,33)(H2,28,29,30)(H2,31,34,36)