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

Systemtic Name: N-(3-bromophenyl)-5,6-dimethyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 7-benzyl-N-(3-bromophenyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: N-(3-bromophenyl)-5,6-dimethyl-7-(phenylmethyl)-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 7-benzyl-N-(3-bromophenyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: (7-benzyl-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-yl)-(3-bromophenyl)amine Formula: C21H19BrN4 MolecularWeight: 407.30636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=NC=N2)NC3=CC(=CC=C3)Br)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(N(C2=C1C(=NC=N2)NC3=CC(=CC=C3)Br)CC4=CC=CC=C4)C

InChI

InChI=1S/C21H19BrN4/c1-14-15(2)26(12-16-7-4-3-5-8-16)21-19(14)20(23-13-24-21)25-18-10-6-9-17(22)11-18/h3-11,13H,12H2,1-2H3,(H,23,24,25)