4-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-amine

Systemtic Name: 4-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-amine Openeye Name: 4-(benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-amine CAS Name: 4-(1-benzothiophen-2-yl)-N-[3-(4-methyl-1-piperazinyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-amine IUPAC Name: 4-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-amine Traditional Name: [4-(benzothiophen-2-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]-[3-(4-methylpiperazino)phenyl]amine Formula: C25H24N6S MolecularWeight: 440.56326

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=CC=C2)NC3=NC(=C4C=CNC4=N3)C5=CC6=CC=CC=C6S5

Isomeric SMILES

CN1CCN(CC1)C2=CC(=CC=C2)NC3=NC(=C4C=CNC4=N3)C5=CC6=CC=CC=C6S5

InChI

InChI=1S/C25H24N6S/c1-30-11-13-31(14-12-30)19-7-4-6-18(16-19)27-25-28-23(20-9-10-26-24(20)29-25)22-15-17-5-2-3-8-21(17)32-22/h2-10,15-16H,11-14H2,1H3,(H2,26,27,28,29)