3-[7-[(4-methoxyphenyl)methyl]-2,6-bis(oxidanylidene)-3-propyl-purin-1-yl]propanamide

Systemtic Name: 3-[7-[(4-methoxyphenyl)methyl]-2,6-bis(oxidanylidene)-3-propyl-purin-1-yl]propanamide Openeye Name: 3-[7-[(4-methoxyphenyl)methyl]-2,6-dioxo-3-propyl-purin-1-yl]propanamide CAS Name: 3-[7-[(4-methoxyphenyl)methyl]-2,6-dioxo-3-propyl-1-purinyl]propanamide IUPAC Name: 3-[7-[(4-methoxyphenyl)methyl]-2,6-dioxo-3-propylpurin-1-yl]propanamide Traditional Name: 3-(2,6-diketo-7-p-anisyl-3-propyl-purin-1-yl)propionamide Formula: C19H23N5O4 MolecularWeight: 385.41702

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC(=O)N)N(C=N2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC(=O)N)N(C=N2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H23N5O4/c1-3-9-23-17-16(18(26)24(19(23)27)10-8-15(20)25)22(12-21-17)11-13-4-6-14(28-2)7-5-13/h4-7,12H,3,8-11H2,1-2H3,(H2,20,25)