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

Systemtic Name: 4-[(2-chloranyl-7H-purin-6-yl)amino]-N-[(2-methoxyphenyl)methyl]butanamide Openeye Name: 4-[(2-chloro-7H-purin-6-yl)amino]-N-[(2-methoxyphenyl)methyl]butanamide CAS Name: 4-[(2-chloro-7H-purin-6-yl)amino]-N-[(2-methoxyphenyl)methyl]butanamide IUPAC Name: 4-[(2-chloro-7H-purin-6-yl)amino]-N-[(2-methoxyphenyl)methyl]butanamide Traditional Name: 4-[(2-chloro-7H-purin-6-yl)amino]-N-o-anisyl-butyramide Formula: C17H19ClN6O2 MolecularWeight: 374.82476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)CCCNC2=NC(=NC3=C2NC=N3)Cl

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)CCCNC2=NC(=NC3=C2NC=N3)Cl

InChI

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