[4-[7-(4-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-[7-(4-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[5-phenyl-7-(p-tolyl)pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[7-(4-methylphenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[7-(4-methylphenyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[5-phenyl-7-(p-tolyl)pyrrolo[2,3-d]pyrimidin-4-yl]piperazino]-(2-thienyl)methanone Formula: C28H25N5OS MolecularWeight: 479.596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3N4CCN(CC4)C(=O)C5=CC=CS5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C3=C2N=CN=C3N4CCN(CC4)C(=O)C5=CC=CS5)C6=CC=CC=C6

InChI

InChI=1S/C28H25N5OS/c1-20-9-11-22(12-10-20)33-18-23(21-6-3-2-4-7-21)25-26(29-19-30-27(25)33)31-13-15-32(16-14-31)28(34)24-8-5-17-35-24/h2-12,17-19H,13-16H2,1H3