N-(3-bromophenyl)-3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanamide

Systemtic Name: N-(3-bromophenyl)-3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-(3-bromophenyl)-3-(6-methyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-(3-bromophenyl)-3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanamide IUPAC Name: N-(3-bromophenyl)-3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanamide Traditional Name: N-(3-bromophenyl)-3-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)propionamide Formula: C14H14BrN3O2S MolecularWeight: 368.24886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=S)N1)CCC(=O)NC2=CC(=CC=C2)Br

Isomeric SMILES

CC1=C(C(=O)NC(=S)N1)CCC(=O)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C14H14BrN3O2S/c1-8-11(13(20)18-14(21)16-8)5-6-12(19)17-10-4-2-3-9(15)7-10/h2-4,7H,5-6H2,1H3,(H,17,19)(H2,16,18,20,21)