(5Z)-2-[(5-azanyl-3-methyl-1-phenyl-pyrazol-4-yl)amino]-5-[(4-bromophenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: (5Z)-2-[(5-azanyl-3-methyl-1-phenyl-pyrazol-4-yl)amino]-5-[(4-bromophenyl)methylidene]-1,3-thiazol-4-one Openeye Name: (5Z)-2-[(5-amino-3-methyl-1-phenyl-pyrazol-4-yl)amino]-5-[(4-bromophenyl)methylene]thiazol-4-one CAS Name: (5Z)-2-[(5-amino-3-methyl-1-phenyl-4-pyrazolyl)amino]-5-[(4-bromophenyl)methylidene]-4-thiazolone IUPAC Name: (5Z)-2-[(5-amino-3-methyl-1-phenylpyrazol-4-yl)amino]-5-[(4-bromophenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5Z)-2-[(5-amino-3-methyl-1-phenyl-pyrazol-4-yl)amino]-5-(4-bromobenzylidene)-2-thiazolin-4-one Formula: C20H16BrN5OS MolecularWeight: 454.34294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1NC2=NC(=O)C(=CC3=CC=C(C=C3)Br)S2)N)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1NC2=NC(=O)/C(=C/C3=CC=C(C=C3)Br)/S2)N)C4=CC=CC=C4

InChI

InChI=1S/C20H16BrN5OS/c1-12-17(18(22)26(25-12)15-5-3-2-4-6-15)23-20-24-19(27)16(28-20)11-13-7-9-14(21)10-8-13/h2-11H,22H2,1H3,(H,23,24,27)/b16-11-