6-azanyl-9-(phenylmethyl)-2-sulfanylidene-1,7-dihydropurin-8-one

Systemtic Name: 6-azanyl-9-(phenylmethyl)-2-sulfanylidene-1,7-dihydropurin-8-one Openeye Name: 6-amino-9-benzyl-2-thioxo-1,7-dihydropurin-8-one CAS Name: 6-amino-9-(phenylmethyl)-2-sulfanylidene-1,7-dihydropurin-8-one IUPAC Name: 6-amino-9-benzyl-2-sulfanylidene-1,7-dihydropurin-8-one Traditional Name: 6-amino-9-benzyl-2-thioxo-1,7-dihydropurin-8-one Formula: C12H11N5OS MolecularWeight: 273.31364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=NC(=S)NC(=C3NC2=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=NC(=S)NC(=C3NC2=O)N

InChI

InChI=1S/C12H11N5OS/c13-9-8-10(16-11(19)15-9)17(12(18)14-8)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,14,18)(H3,13,15,16,19)