(3-aminophenyl)-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)methanone

Systemtic Name: (3-aminophenyl)-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)methanone Openeye Name: (4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-(3-aminophenyl)methanone CAS Name: (4-amino-7-cyclopentyl-5-pyrrolo[2,3-d]pyrimidinyl)-(3-aminophenyl)methanone IUPAC Name: (4-amino-7-cyclopentylpyrrolo[2,3-d]pyrimidin-5-yl)-(3-aminophenyl)methanone Traditional Name: (4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-(3-aminophenyl)methanone Formula: C18H19N5O MolecularWeight: 321.37636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C(=O)C4=CC(=CC=C4)N

Isomeric SMILES

C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C(=O)C4=CC(=CC=C4)N

InChI

InChI=1S/C18H19N5O/c19-12-5-3-4-11(8-12)16(24)14-9-23(13-6-1-2-7-13)18-15(14)17(20)21-10-22-18/h3-5,8-10,13H,1-2,6-7,19H2,(H2,20,21,22)