N-[4-[2-[8-cyclopentyl-2,6-bis(oxidanylidene)-1-propyl-7H-purin-3-yl]ethyl]phenyl]butanamide

Systemtic Name: N-[4-[2-[8-cyclopentyl-2,6-bis(oxidanylidene)-1-propyl-7H-purin-3-yl]ethyl]phenyl]butanamide Openeye Name: N-[4-[2-(8-cyclopentyl-2,6-dioxo-1-propyl-7H-purin-3-yl)ethyl]phenyl]butanamide CAS Name: N-[4-[2-(8-cyclopentyl-2,6-dioxo-1-propyl-7H-purin-3-yl)ethyl]phenyl]butanamide IUPAC Name: N-[4-[2-(8-cyclopentyl-2,6-dioxo-1-propyl-7H-purin-3-yl)ethyl]phenyl]butanamide Traditional Name: N-[4-[2-(8-cyclopentyl-2,6-diketo-1-propyl-7H-purin-3-yl)ethyl]phenyl]butyramide Formula: C25H33N5O3 MolecularWeight: 451.56122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)CCN2C3=C(C(=O)N(C2=O)CCC)NC(=N3)C4CCCC4

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)CCN2C3=C(C(=O)N(C2=O)CCC)NC(=N3)C4CCCC4

InChI

InChI=1S/C25H33N5O3/c1-3-7-20(31)26-19-12-10-17(11-13-19)14-16-29-23-21(24(32)30(15-4-2)25(29)33)27-22(28-23)18-8-5-6-9-18/h10-13,18H,3-9,14-16H2,1-2H3,(H,26,31)(H,27,28)