8-[(6-ethoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-9-methyl-3H-purin-6-one

Systemtic Name: 8-[(6-ethoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-9-methyl-3H-purin-6-one Openeye Name: 8-[(6-ethoxy-2-oxo-chromen-4-yl)methylsulfanyl]-9-methyl-3H-purin-6-one CAS Name: 8-[(6-ethoxy-2-oxo-1-benzopyran-4-yl)methylthio]-9-methyl-3H-purin-6-one IUPAC Name: 8-[(6-ethoxy-2-oxochromen-4-yl)methylsulfanyl]-9-methyl-3H-purin-6-one Traditional Name: 8-[(6-ethoxy-2-keto-chromen-4-yl)methylthio]-9-methyl-3H-purin-6-one Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=O)C=C2CSC3=NC4=C(N3C)NC=NC4=O

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=O)C=C2CSC3=NC4=C(N3C)NC=NC4=O

InChI

InChI=1S/C18H16N4O4S/c1-3-25-11-4-5-13-12(7-11)10(6-14(23)26-13)8-27-18-21-15-16(22(18)2)19-9-20-17(15)24/h4-7,9H,3,8H2,1-2H3,(H,19,20,24)