N-(3-imidazol-1-ylpropyl)-5,6-dimethyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(3-imidazol-1-ylpropyl)-5,6-dimethyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 7-benzyl-N-(3-imidazol-1-ylpropyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: N-[3-(1-imidazolyl)propyl]-5,6-dimethyl-7-(phenylmethyl)-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 7-benzyl-N-(3-imidazol-1-ylpropyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: (7-benzyl-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-yl)-(3-imidazol-1-ylpropyl)amine Formula: C21H24N6 MolecularWeight: 360.45546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=NC=N2)NCCCN3C=CN=C3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(N(C2=C1C(=NC=N2)NCCCN3C=CN=C3)CC4=CC=CC=C4)C

InChI

InChI=1S/C21H24N6/c1-16-17(2)27(13-18-7-4-3-5-8-18)21-19(16)20(24-14-25-21)23-9-6-11-26-12-10-22-15-26/h3-5,7-8,10,12,14-15H,6,9,11,13H2,1-2H3,(H,23,24,25)