1-[4-(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[4-(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenoxy-ethanone CAS Name: 1-[4-(5,7-diphenyl-4-pyrrolo[2,3-d]pyrimidinyl)-1-piperazinyl]-2-phenoxyethanone IUPAC Name: 1-[4-(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenoxyethanone Traditional Name: 1-[4-(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)piperazino]-2-phenoxy-ethanone Formula: C30H27N5O2 MolecularWeight: 489.56768

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2C(=CN3C4=CC=CC=C4)C5=CC=CC=C5)C(=O)COC6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2C(=CN3C4=CC=CC=C4)C5=CC=CC=C5)C(=O)COC6=CC=CC=C6

InChI

InChI=1S/C30H27N5O2/c36-27(21-37-25-14-8-3-9-15-25)33-16-18-34(19-17-33)29-28-26(23-10-4-1-5-11-23)20-35(30(28)32-22-31-29)24-12-6-2-7-13-24/h1-15,20,22H,16-19,21H2