1,3-bis(4-methoxyphenyl)-5-[(phenethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1,3-bis(4-methoxyphenyl)-5-[(phenethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1,3-bis(4-methoxyphenyl)-5-[(phenethylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1,3-bis(4-methoxyphenyl)-5-[(phenethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1,3-bis(4-methoxyphenyl)-5-[(phenethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1,3-bis(4-methoxyphenyl)-5-[(phenethylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C27H25N3O4S MolecularWeight: 487.5701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C(=CNCCC3=CC=CC=C3)C(=O)N(C2=S)C4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C(=CNCCC3=CC=CC=C3)C(=O)N(C2=S)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H25N3O4S/c1-33-22-12-8-20(9-13-22)29-25(31)24(18-28-17-16-19-6-4-3-5-7-19)26(32)30(27(29)35)21-10-14-23(34-2)15-11-21/h3-15,18,28H,16-17H2,1-2H3