8-(2-morpholin-4-ylethylsulfanyl)-9-(phenylmethyl)purin-6-amine

Systemtic Name: 8-(2-morpholin-4-ylethylsulfanyl)-9-(phenylmethyl)purin-6-amine Openeye Name: 9-benzyl-8-(2-morpholinoethylsulfanyl)purin-6-amine CAS Name: 8-[2-(4-morpholinyl)ethylthio]-9-(phenylmethyl)-6-purinamine IUPAC Name: 9-benzyl-8-(2-morpholin-4-ylethylsulfanyl)purin-6-amine Traditional Name: [9-benzyl-8-(2-morpholinoethylthio)purin-6-yl]amine Formula: C18H22N6OS MolecularWeight: 370.47188

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCSC2=NC3=C(N2CC4=CC=CC=C4)N=CN=C3N

Isomeric SMILES

C1COCCN1CCSC2=NC3=C(N2CC4=CC=CC=C4)N=CN=C3N

InChI

InChI=1S/C18H22N6OS/c19-16-15-17(21-13-20-16)24(12-14-4-2-1-3-5-14)18(22-15)26-11-8-23-6-9-25-10-7-23/h1-5,13H,6-12H2,(H2,19,20,21)