1-(4-bromanyl-3-methyl-phenyl)-5-(thiophen-3-ylmethylidene)-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-5-(thiophen-3-ylmethylidene)-1,3-diazinane-2,4,6-trione Openeye Name: 1-(4-bromo-3-methyl-phenyl)-5-(3-thienylmethylene)hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-bromo-3-methylphenyl)-5-(3-thiophenylmethylidene)-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-bromo-3-methylphenyl)-5-(thiophen-3-ylmethylidene)-1,3-diazinane-2,4,6-trione Traditional Name: 1-(4-bromo-3-methyl-phenyl)-5-(3-thenylidene)barbituric acid Formula: C16H11BrN2O3S MolecularWeight: 391.23914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C(=O)C(=CC3=CSC=C3)C(=O)NC2=O)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2C(=O)C(=CC3=CSC=C3)C(=O)NC2=O)Br

InChI

InChI=1S/C16H11BrN2O3S/c1-9-6-11(2-3-13(9)17)19-15(21)12(14(20)18-16(19)22)7-10-4-5-23-8-10/h2-8H,1H3,(H,18,20,22)