5,6-dimethyl-7-(4-methylphenyl)-N-(pyridin-3-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 5,6-dimethyl-7-(4-methylphenyl)-N-(pyridin-3-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 5,6-dimethyl-7-(p-tolyl)-N-(3-pyridylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 5,6-dimethyl-7-(4-methylphenyl)-N-(3-pyridinylmethyl)-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 5,6-dimethyl-7-(4-methylphenyl)-N-(pyridin-3-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [5,6-dimethyl-7-(p-tolyl)pyrrolo[2,3-d]pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C21H21N5 MolecularWeight: 343.42494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C3=C2N=CN=C3NCC4=CN=CC=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C3=C2N=CN=C3NCC4=CN=CC=C4)C)C

InChI

InChI=1S/C21H21N5/c1-14-6-8-18(9-7-14)26-16(3)15(2)19-20(24-13-25-21(19)26)23-12-17-5-4-10-22-11-17/h4-11,13H,12H2,1-3H3,(H,23,24,25)