5-[(3-bromanyl-5-ethoxy-4-propoxy-phenyl)methylidene]-1,3-bis(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(3-bromanyl-5-ethoxy-4-propoxy-phenyl)methylidene]-1,3-bis(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-bromo-5-ethoxy-4-propoxy-phenyl)methylene]-1,3-bis(p-tolyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3-bromo-5-ethoxy-4-propoxyphenyl)methylidene]-1,3-bis(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3-bromo-5-ethoxy-4-propoxyphenyl)methylidene]-1,3-bis(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3-bromo-5-ethoxy-4-propoxy-benzylidene)-1,3-bis(p-tolyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C30H29BrN2O4S MolecularWeight: 593.53126

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C)OCC

InChI

InChI=1S/C30H29BrN2O4S/c1-5-15-37-27-25(31)17-21(18-26(27)36-6-2)16-24-28(34)32(22-11-7-19(3)8-12-22)30(38)33(29(24)35)23-13-9-20(4)10-14-23/h7-14,16-18H,5-6,15H2,1-4H3