4-[[5-(3-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[5-(3-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[5-(3-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[5-(3-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[5-(3-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[5-(3-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C20H18BrN5OS MolecularWeight: 456.35882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=NN=C(CS3)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=NN=C(CS3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H18BrN5OS/c1-13-18(19(27)26(25(13)2)16-9-4-3-5-10-16)22-20-24-23-17(12-28-20)14-7-6-8-15(21)11-14/h3-11H,12H2,1-2H3,(H,22,24)