2-azanyl-8-[(5-methylsulfonylthiophen-2-yl)methyl]-3,7-dihydropurin-6-one

Systemtic Name: 2-azanyl-8-[(5-methylsulfonylthiophen-2-yl)methyl]-3,7-dihydropurin-6-one Openeye Name: 2-amino-8-[(5-methylsulfonyl-2-thienyl)methyl]-3,7-dihydropurin-6-one CAS Name: 2-amino-8-[(5-methylsulfonyl-2-thiophenyl)methyl]-3,7-dihydropurin-6-one IUPAC Name: 2-amino-8-[(5-methylsulfonylthiophen-2-yl)methyl]-3,7-dihydropurin-6-one Traditional Name: 2-amino-8-[(5-mesyl-2-thienyl)methyl]-3,7-dihydropurin-6-one Formula: C11H11N5O3S2 MolecularWeight: 325.36674

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(S1)CC2=NC3=C(N2)C(=O)N=C(N3)N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(S1)CC2=NC3=C(N2)C(=O)N=C(N3)N

InChI

InChI=1S/C11H11N5O3S2/c1-21(18,19)7-3-2-5(20-7)4-6-13-8-9(14-6)15-11(12)16-10(8)17/h2-3H,4H2,1H3,(H4,12,13,14,15,16,17)