6-[(2,4,6-trimethylphenyl)methylsulfanyl]-3,7-dihydropurin-2-one

Systemtic Name: 6-[(2,4,6-trimethylphenyl)methylsulfanyl]-3,7-dihydropurin-2-one Openeye Name: 6-[(2,4,6-trimethylphenyl)methylsulfanyl]-3,7-dihydropurin-2-one CAS Name: 6-[(2,4,6-trimethylphenyl)methylthio]-3,7-dihydropurin-2-one IUPAC Name: 6-[(2,4,6-trimethylphenyl)methylsulfanyl]-3,7-dihydropurin-2-one Traditional Name: 6-[(2,4,6-trimethylbenzyl)thio]-3,7-dihydropurin-2-one Formula: C15H16N4OS MolecularWeight: 300.37874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CSC2=NC(=O)NC3=C2NC=N3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CSC2=NC(=O)NC3=C2NC=N3)C

InChI

InChI=1S/C15H16N4OS/c1-8-4-9(2)11(10(3)5-8)6-21-14-12-13(17-7-16-12)18-15(20)19-14/h4-5,7H,6H2,1-3H3,(H2,16,17,18,19,20)