[[8-chloranyl-6-[(phenylmethyl)amino]-7H-purin-2-yl]-propyl-amino]methanol

Systemtic Name: [[8-chloranyl-6-[(phenylmethyl)amino]-7H-purin-2-yl]-propyl-amino]methanol Openeye Name: [[6-(benzylamino)-8-chloro-7H-purin-2-yl]-propyl-amino]methanol CAS Name: [[8-chloro-6-[(phenylmethyl)amino]-7H-purin-2-yl]-propylamino]methanol IUPAC Name: [[6-(benzylamino)-8-chloro-7H-purin-2-yl]-propylamino]methanol Traditional Name: [[6-(benzylamino)-8-chloro-7H-purin-2-yl]-propyl-amino]methanol Formula: C16H19ClN6O MolecularWeight: 346.81466

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CO)C1=NC2=C(C(=N1)NCC3=CC=CC=C3)NC(=N2)Cl

Isomeric SMILES

CCCN(CO)C1=NC2=C(C(=N1)NCC3=CC=CC=C3)NC(=N2)Cl

InChI

InChI=1S/C16H19ClN6O/c1-2-8-23(10-24)16-21-13(12-14(22-16)20-15(17)19-12)18-9-11-6-4-3-5-7-11/h3-7,24H,2,8-10H2,1H3,(H2,18,19,20,21,22)