4-azanyl-2-phenyl-3-(phenylmethyl)-6-propoxy-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-phenyl-3-(phenylmethyl)-6-propoxy-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Openeye Name: 4-amino-3-benzyl-2-phenyl-6-propoxy-pyrrolo[2,3-d]pyrimidine-5-carbonitrile CAS Name: 4-amino-2-phenyl-3-(phenylmethyl)-6-propoxy-5-pyrrolo[2,3-d]pyrimidinecarbonitrile IUPAC Name: 4-amino-3-benzyl-2-phenyl-6-propoxypyrrolo[2,3-d]pyrimidine-5-carbonitrile Traditional Name: 4-amino-3-benzyl-2-phenyl-6-propoxy-pyrrolo[2,3-d]pyrimidine-5-carbonitrile Formula: C23H21N5O MolecularWeight: 383.44574

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C2=C(N(C(=NC2=N1)C3=CC=CC=C3)CC4=CC=CC=C4)N)C#N

Isomeric SMILES

CCCOC1=C(C2=C(N(C(=NC2=N1)C3=CC=CC=C3)CC4=CC=CC=C4)N)C#N

InChI

InChI=1S/C23H21N5O/c1-2-13-29-23-18(14-24)19-20(25)28(15-16-9-5-3-6-10-16)22(26-21(19)27-23)17-11-7-4-8-12-17/h3-12H,2,13,15,25H2,1H3