2-(2-methylpropyl)-4-(2-phenylpiperidin-4-yl)-5H-pyrrolo[3,2-d]pyrimidine

Systemtic Name: 2-(2-methylpropyl)-4-(2-phenylpiperidin-4-yl)-5H-pyrrolo[3,2-d]pyrimidine Openeye Name: 2-isobutyl-4-(2-phenyl-4-piperidyl)-5H-pyrrolo[3,2-d]pyrimidine CAS Name: 2-(2-methylpropyl)-4-(2-phenyl-4-piperidinyl)-5H-pyrrolo[3,2-d]pyrimidine IUPAC Name: 2-(2-methylpropyl)-4-(2-phenylpiperidin-4-yl)-5H-pyrrolo[3,2-d]pyrimidine Traditional Name: 2-isobutyl-4-(2-phenyl-4-piperidyl)-5H-pyrrolo[3,2-d]pyrimidine Formula: C21H26N4 MolecularWeight: 334.45794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC2=C(C(=N1)C3CCNC(C3)C4=CC=CC=C4)NC=C2

Isomeric SMILES

CC(C)CC1=NC2=C(C(=N1)C3CCNC(C3)C4=CC=CC=C4)NC=C2

InChI

InChI=1S/C21H26N4/c1-14(2)12-19-24-17-9-11-23-21(17)20(25-19)16-8-10-22-18(13-16)15-6-4-3-5-7-15/h3-7,9,11,14,16,18,22-23H,8,10,12-13H2,1-2H3