N-phenethyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-amine

Systemtic Name: N-phenethyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-amine Openeye Name: N-phenethyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)spiro[indoline-3,4'-piperidine]-5-amine CAS Name: N-phenethyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-5-spiro[2H-indole-3,4'-piperidine]amine IUPAC Name: N-phenethyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-5-amine Traditional Name: phenethyl-[1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)spiro[indoline-3,4'-piperidine]-5-yl]amine Formula: C26H28N6 MolecularWeight: 424.54072

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC12CN(C3=C2C=C(C=C3)NCCC4=CC=CC=C4)C5=NC=NC6=C5C=CN6

Isomeric SMILES

C1CNCCC12CN(C3=C2C=C(C=C3)NCCC4=CC=CC=C4)C5=NC=NC6=C5C=CN6

InChI

InChI=1S/C26H28N6/c1-2-4-19(5-3-1)8-12-28-20-6-7-23-22(16-20)26(10-14-27-15-11-26)17-32(23)25-21-9-13-29-24(21)30-18-31-25/h1-7,9,13,16,18,27-28H,8,10-12,14-15,17H2,(H,29,30,31)