2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-methyl-3-oxidanylidene-N-phenyl-1H-pyrazole-4-carbothioamide

Systemtic Name: 2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-methyl-3-oxidanylidene-N-phenyl-1H-pyrazole-4-carbothioamide Openeye Name: 2-[4-(4-bromophenyl)thiazol-2-yl]-5-methyl-3-oxo-N-phenyl-1H-pyrazole-4-carbothioamide CAS Name: 2-[4-(4-bromophenyl)-2-thiazolyl]-5-methyl-3-oxo-N-phenyl-1H-pyrazole-4-carbothioamide IUPAC Name: 2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-methyl-3-oxo-N-phenyl-1H-pyrazole-4-carbothioamide Traditional Name: 1-[4-(4-bromophenyl)thiazol-2-yl]-5-keto-3-methyl-N-phenyl-3-pyrazoline-4-carbothioamide Formula: C20H15BrN4OS2 MolecularWeight: 471.3933

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=NC(=CS2)C3=CC=C(C=C3)Br)C(=S)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=NC(=CS2)C3=CC=C(C=C3)Br)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C20H15BrN4OS2/c1-12-17(18(27)22-15-5-3-2-4-6-15)19(26)25(24-12)20-23-16(11-28-20)13-7-9-14(21)10-8-13/h2-11,24H,1H3,(H,22,27)