2-azanyl-9-(2-hydroxyethyloxymethyl)-7-prop-2-enyl-8-sulfanylidene-3H-purin-6-one

Systemtic Name: 2-azanyl-9-(2-hydroxyethyloxymethyl)-7-prop-2-enyl-8-sulfanylidene-3H-purin-6-one Openeye Name: 7-allyl-2-amino-9-(2-hydroxyethoxymethyl)-8-thioxo-3H-purin-6-one CAS Name: 2-amino-9-(2-hydroxyethoxymethyl)-7-prop-2-enyl-8-sulfanylidene-3H-purin-6-one IUPAC Name: 2-amino-9-(2-hydroxyethoxymethyl)-7-prop-2-enyl-8-sulfanylidene-3H-purin-6-one Traditional Name: 7-allyl-2-amino-9-(2-hydroxyethoxymethyl)-8-thioxo-3H-purin-6-one Formula: C11H15N5O3S MolecularWeight: 297.3335

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(NC(=NC2=O)N)N(C1=S)COCCO

Isomeric SMILES

C=CCN1C2=C(NC(=NC2=O)N)N(C1=S)COCCO

InChI

InChI=1S/C11H15N5O3S/c1-2-3-15-7-8(13-10(12)14-9(7)18)16(11(15)20)6-19-5-4-17/h2,17H,1,3-6H2,(H3,12,13,14,18)