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2-[(2-aminophenyl)methylsulfanyl]-3,5-dihydropurin-6-one

2-[(2-aminophenyl)methylsulfanyl]-3,5-dihydropurin-6-one

Systemtic Name:2-[(2-aminophenyl)methylsulfanyl]-3,5-dihydropurin-6-one
Openeye Name:2-[(2-aminophenyl)methylsulfanyl]-3,5-dihydropurin-6-one
CAS Name:2-[(2-aminophenyl)methylthio]-3,5-dihydropurin-6-one
IUPAC Name:2-[(2-aminophenyl)methylsulfanyl]-3,5-dihydropurin-6-one
Traditional Name:2-[(2-aminobenzyl)thio]-3,5-dihydropurin-6-one
Formula: C12H11N5OS
MolecularWeight: 273.31364
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC(=O)C3C(=NC=N3)N2)N


Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC(=O)C3C(=NC=N3)N2)N


InChI

InChI=1S/C12H11N5OS/c13-8-4-2-1-3-7(8)5-19-12-16-10-9(11(18)17-12)14-6-15-10/h1-4,6,9H,5,13H2,(H,14,15,16,17,18)


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