5-[[3-bromanyl-4-(dimethylamino)phenyl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[3-bromanyl-4-(dimethylamino)phenyl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-allyl-5-[[3-bromo-4-(dimethylamino)phenyl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-allyl-5-[3-bromo-4-(dimethylamino)benzylidene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H16BrN3O2S MolecularWeight: 394.28614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)CC=C)Br

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)CC=C)Br

InChI

InChI=1S/C16H16BrN3O2S/c1-4-7-20-15(22)11(14(21)18-16(20)23)8-10-5-6-13(19(2)3)12(17)9-10/h4-6,8-9H,1,7H2,2-3H3,(H,18,21,23)