3,7-dimethyl-8-[(E)-2-phenylethenyl]-6-sulfanylidene-purin-2-one

Systemtic Name: 3,7-dimethyl-8-[(E)-2-phenylethenyl]-6-sulfanylidene-purin-2-one Openeye Name: 3,7-dimethyl-8-[(E)-styryl]-6-thioxo-purin-2-one CAS Name: 3,7-dimethyl-8-[(E)-2-phenylethenyl]-6-sulfanylidene-2-purinone IUPAC Name: 3,7-dimethyl-8-[(E)-2-phenylethenyl]-6-sulfanylidenepurin-2-one Traditional Name: 3,7-dimethyl-8-[(E)-styryl]-6-thioxo-purin-2-one Formula: C15H14N4OS MolecularWeight: 298.36286

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=C1C(=S)NC(=O)N2C)C=CC3=CC=CC=C3

Isomeric SMILES

CN1C(=NC2=C1C(=S)NC(=O)N2C)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C15H14N4OS/c1-18-11(9-8-10-6-4-3-5-7-10)16-13-12(18)14(21)17-15(20)19(13)2/h3-9H,1-2H3,(H,17,20,21)/b9-8+