1-(3,4-dihydro-2H-quinolin-1-yl)-2-(7H-purin-6-ylsulfanyl)ethanone

Systemtic Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(7H-purin-6-ylsulfanyl)ethanone Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(7H-purin-6-ylsulfanyl)ethanone CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(7H-purin-6-ylthio)ethanone IUPAC Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(7H-purin-6-ylsulfanyl)ethanone Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(7H-purin-6-ylthio)ethanone Formula: C16H15N5OS MolecularWeight: 325.3882

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(=O)CSC3=NC=NC4=C3NC=N4

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=O)CSC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C16H15N5OS/c22-13(21-7-3-5-11-4-1-2-6-12(11)21)8-23-16-14-15(18-9-17-14)19-10-20-16/h1-2,4,6,9-10H,3,5,7-8H2,(H,17,18,19,20)