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

Systemtic Name: [4-(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-(5,7-diphenyl-4-pyrrolo[2,3-d]pyrimidinyl)-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-(5,7-diphenylpyrrolo[2,3-d]pyrimidin-4-yl)piperazino]-(2-thienyl)methanone Formula: C27H23N5OS MolecularWeight: 465.56942

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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)C6=CC=CS6

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2C(=CN3C4=CC=CC=C4)C5=CC=CC=C5)C(=O)C6=CC=CS6

InChI

InChI=1S/C27H23N5OS/c33-27(23-12-7-17-34-23)31-15-13-30(14-16-31)25-24-22(20-8-3-1-4-9-20)18-32(26(24)29-19-28-25)21-10-5-2-6-11-21/h1-12,17-19H,13-16H2