3-[(2-chloranyl-7H-purin-6-yl)amino]-N-[2-(4-methoxyphenyl)ethyl]propanamide

Systemtic Name: 3-[(2-chloranyl-7H-purin-6-yl)amino]-N-[2-(4-methoxyphenyl)ethyl]propanamide Openeye Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-[2-(4-methoxyphenyl)ethyl]propanamide CAS Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-[2-(4-methoxyphenyl)ethyl]propanamide IUPAC Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-[2-(4-methoxyphenyl)ethyl]propanamide Traditional Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-[2-(4-methoxyphenyl)ethyl]propionamide Formula: C17H19ClN6O2 MolecularWeight: 374.82476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)CCNC2=NC(=NC3=C2NC=N3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)CCNC2=NC(=NC3=C2NC=N3)Cl

InChI

InChI=1S/C17H19ClN6O2/c1-26-12-4-2-11(3-5-12)6-8-19-13(25)7-9-20-15-14-16(22-10-21-14)24-17(18)23-15/h2-5,10H,6-9H2,1H3,(H,19,25)(H2,20,21,22,23,24)