3-[4-azanyl-7-[1-[2-(2-azanylethoxy)ethyl]piperidin-4-yl]pyrrolo[2,3-d]pyrimidin-5-yl]phenol

Systemtic Name: 3-[4-azanyl-7-[1-[2-(2-azanylethoxy)ethyl]piperidin-4-yl]pyrrolo[2,3-d]pyrimidin-5-yl]phenol Openeye Name: 3-[4-amino-7-[1-[2-(2-aminoethoxy)ethyl]-4-piperidyl]pyrrolo[2,3-d]pyrimidin-5-yl]phenol CAS Name: 3-[4-amino-7-[1-[2-(2-aminoethoxy)ethyl]-4-piperidinyl]-5-pyrrolo[2,3-d]pyrimidinyl]phenol IUPAC Name: 3-[4-amino-7-[1-[2-(2-aminoethoxy)ethyl]piperidin-4-yl]pyrrolo[2,3-d]pyrimidin-5-yl]phenol Traditional Name: 3-[4-amino-7-[1-[2-(2-aminoethoxy)ethyl]-4-piperidyl]pyrrolo[2,3-d]pyrimidin-5-yl]phenol Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=C(C3=C2N=CN=C3N)C4=CC(=CC=C4)O)CCOCCN

Isomeric SMILES

C1CN(CCC1N2C=C(C3=C2N=CN=C3N)C4=CC(=CC=C4)O)CCOCCN

InChI

InChI=1S/C21H28N6O2/c22-6-10-29-11-9-26-7-4-16(5-8-26)27-13-18(15-2-1-3-17(28)12-15)19-20(23)24-14-25-21(19)27/h1-3,12-14,16,28H,4-11,22H2,(H2,23,24,25)