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6,7-bis(3,4-dimethoxyphenyl)-2-sulfanylidene-1H-pteridin-4-one

6,7-bis(3,4-dimethoxyphenyl)-2-sulfanylidene-1H-pteridin-4-one

Systemtic Name:6,7-bis(3,4-dimethoxyphenyl)-2-sulfanylidene-1H-pteridin-4-one
Openeye Name:6,7-bis(3,4-dimethoxyphenyl)-2-thioxo-1H-pteridin-4-one
CAS Name:6,7-bis(3,4-dimethoxyphenyl)-2-sulfanylidene-1H-pteridin-4-one
IUPAC Name:6,7-bis(3,4-dimethoxyphenyl)-2-sulfanylidene-1H-pteridin-4-one
Traditional Name:6,7-bis(3,4-dimethoxyphenyl)-2-thioxo-1H-pteridin-4-one
Formula: C22H20N4O5S
MolecularWeight: 452.483
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(NC(=S)NC3=O)N=C2C4=CC(=C(C=C4)OC)OC)OC


Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(NC(=S)NC3=O)N=C2C4=CC(=C(C=C4)OC)OC)OC


InChI

InChI=1S/C22H20N4O5S/c1-28-13-7-5-11(9-15(13)30-3)17-18(12-6-8-14(29-2)16(10-12)31-4)24-20-19(23-17)21(27)26-22(32)25-20/h5-10H,1-4H3,(H2,24,25,26,27,32)


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