5-[[4-bromanyl-5-(4-chlorophenyl)sulfanyl-furan-2-yl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[4-bromanyl-5-(4-chlorophenyl)sulfanyl-furan-2-yl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-allyl-5-[[4-bromo-5-(4-chlorophenyl)sulfanyl-2-furyl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[4-bromo-5-[(4-chlorophenyl)thio]-2-furanyl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[4-bromo-5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-allyl-5-[[4-bromo-5-[(4-chlorophenyl)thio]-2-furyl]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H12BrClN2O3S2 MolecularWeight: 483.78648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CC2=CC(=C(O2)SC3=CC=C(C=C3)Cl)Br)C(=O)NC1=S

Isomeric SMILES

C=CCN1C(=O)C(=CC2=CC(=C(O2)SC3=CC=C(C=C3)Cl)Br)C(=O)NC1=S

InChI

InChI=1S/C18H12BrClN2O3S2/c1-2-7-22-16(24)13(15(23)21-18(22)26)8-11-9-14(19)17(25-11)27-12-5-3-10(20)4-6-12/h2-6,8-9H,1,7H2,(H,21,23,26)