3-[(2-chloranyl-7H-purin-6-yl)amino]-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]propanamide

Systemtic Name: 3-[(2-chloranyl-7H-purin-6-yl)amino]-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]propanamide Openeye Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]propanamide CAS Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]propanamide IUPAC Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]propanamide Traditional Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]propionamide Formula: C19H20ClN7O2 MolecularWeight: 413.8608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CN2)CCNC(=O)CCNC3=NC(=NC4=C3NC=N4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CN2)CCNC(=O)CCNC3=NC(=NC4=C3NC=N4)Cl

InChI

InChI=1S/C19H20ClN7O2/c1-29-12-2-3-13-11(9-23-14(13)8-12)4-6-21-15(28)5-7-22-17-16-18(25-10-24-16)27-19(20)26-17/h2-3,8-10,23H,4-7H2,1H3,(H,21,28)(H2,22,24,25,26,27)