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

Systemtic Name: 3-[(2-chloranyl-7H-purin-6-yl)amino]-N-[(4-methoxyphenyl)methyl]propanamide Openeye Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-[(4-methoxyphenyl)methyl]propanamide CAS Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-[(4-methoxyphenyl)methyl]propanamide IUPAC Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-[(4-methoxyphenyl)methyl]propanamide Traditional Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-p-anisyl-propionamide Formula: C16H17ClN6O2 MolecularWeight: 360.79818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17ClN6O2/c1-25-11-4-2-10(3-5-11)8-19-12(24)6-7-18-14-13-15(21-9-20-13)23-16(17)22-14/h2-5,9H,6-8H2,1H3,(H,19,24)(H2,18,20,21,22,23)