(Z)-2-[9-(oxolan-2-yl)purin-6-yl]-3-phenylazanyl-prop-2-enamide

Systemtic Name: (Z)-2-[9-(oxolan-2-yl)purin-6-yl]-3-phenylazanyl-prop-2-enamide Openeye Name: (Z)-3-anilino-2-(9-tetrahydrofuran-2-ylpurin-6-yl)prop-2-enamide CAS Name: (Z)-3-anilino-2-[9-(2-oxolanyl)-6-purinyl]-2-propenamide IUPAC Name: (Z)-3-anilino-2-[9-(oxolan-2-yl)purin-6-yl]prop-2-enamide Traditional Name: (Z)-3-anilino-2-[9-(tetrahydrofuryl)purin-6-yl]acrylamide Formula: C18H18N6O2 MolecularWeight: 350.37452

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)N2C=NC3=C(N=CN=C32)C(=CNC4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1CC(OC1)N2C=NC3=C(N=CN=C32)/C(=C/NC4=CC=CC=C4)/C(=O)N

InChI

InChI=1S/C18H18N6O2/c19-17(25)13(9-20-12-5-2-1-3-6-12)15-16-18(22-10-21-15)24(11-23-16)14-7-4-8-26-14/h1-3,5-6,9-11,14,20H,4,7-8H2,(H2,19,25)/b13-9-