5-(1H-indol-3-ylmethylidene)-2-sulfanylidene-1-(3,4,5-trimethoxyphenyl)-1,3-diazinane-4,6-dione

Systemtic Name: 5-(1H-indol-3-ylmethylidene)-2-sulfanylidene-1-(3,4,5-trimethoxyphenyl)-1,3-diazinane-4,6-dione Openeye Name: 5-(1H-indol-3-ylmethylene)-2-thioxo-1-(3,4,5-trimethoxyphenyl)hexahydropyrimidine-4,6-dione CAS Name: 5-(1H-indol-3-ylmethylidene)-2-sulfanylidene-1-(3,4,5-trimethoxyphenyl)-1,3-diazinane-4,6-dione IUPAC Name: 5-(1H-indol-3-ylmethylidene)-2-sulfanylidene-1-(3,4,5-trimethoxyphenyl)-1,3-diazinane-4,6-dione Traditional Name: 5-(1H-indol-3-ylmethylene)-2-thioxo-1-(3,4,5-trimethoxyphenyl)hexahydropyrimidine-4,6-quinone Formula: C22H19N3O5S MolecularWeight: 437.46836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)N2C(=O)C(=CC3=CNC4=CC=CC=C43)C(=O)NC2=S

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)N2C(=O)C(=CC3=CNC4=CC=CC=C43)C(=O)NC2=S

InChI

InChI=1S/C22H19N3O5S/c1-28-17-9-13(10-18(29-2)19(17)30-3)25-21(27)15(20(26)24-22(25)31)8-12-11-23-16-7-5-4-6-14(12)16/h4-11,23H,1-3H3,(H,24,26,31)