2-azanyl-4-oxidanylidene-7-(phenylmethyl)-3-(propan-2-yloxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbaldehyde

Systemtic Name: 2-azanyl-4-oxidanylidene-7-(phenylmethyl)-3-(propan-2-yloxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbaldehyde Openeye Name: 2-amino-7-benzyl-3-(isopropoxymethyl)-4-oxo-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde CAS Name: 2-amino-4-oxo-7-(phenylmethyl)-3-(propan-2-yloxymethyl)-5-pyrrolo[2,3-d]pyrimidinecarboxaldehyde IUPAC Name: 2-amino-7-benzyl-4-oxo-3-(propan-2-yloxymethyl)pyrrolo[2,3-d]pyrimidine-5-carbaldehyde Traditional Name: 2-amino-7-benzyl-3-(isopropoxymethyl)-4-keto-pyrrolo[2,3-d]pyrimidine-5-carbaldehyde Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCN1C(=O)C2=C(N=C1N)N(C=C2C=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)OCN1C(=O)C2=C(N=C1N)N(C=C2C=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H20N4O3/c1-12(2)25-11-22-17(24)15-14(10-23)9-21(16(15)20-18(22)19)8-13-6-4-3-5-7-13/h3-7,9-10,12H,8,11H2,1-2H3,(H2,19,20)