N-[3-(6-azanyl-2-butoxy-8-oxidanylidene-7H-purin-9-yl)propyl]-N-(phenylmethyl)-3-pyrazin-2-yl-propanamide

Systemtic Name: N-[3-(6-azanyl-2-butoxy-8-oxidanylidene-7H-purin-9-yl)propyl]-N-(phenylmethyl)-3-pyrazin-2-yl-propanamide Openeye Name: N-[3-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)propyl]-N-benzyl-3-pyrazin-2-yl-propanamide CAS Name: N-[3-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)propyl]-N-(phenylmethyl)-3-(2-pyrazinyl)propanamide IUPAC Name: N-[3-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)propyl]-N-benzyl-3-pyrazin-2-ylpropanamide Traditional Name: N-[3-(6-amino-2-butoxy-8-keto-7H-purin-9-yl)propyl]-N-benzyl-3-pyrazin-2-yl-propionamide Formula: C26H32N8O3 MolecularWeight: 504.58408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCCN(CC3=CC=CC=C3)C(=O)CCC4=NC=CN=C4

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCCN(CC3=CC=CC=C3)C(=O)CCC4=NC=CN=C4

InChI

InChI=1S/C26H32N8O3/c1-2-3-16-37-25-31-23(27)22-24(32-25)34(26(36)30-22)15-7-14-33(18-19-8-5-4-6-9-19)21(35)11-10-20-17-28-12-13-29-20/h4-6,8-9,12-13,17H,2-3,7,10-11,14-16,18H2,1H3,(H,30,36)(H2,27,31,32)