N-(4-bromophenyl)-5-methyl-3-oxidanylidene-2-[(Z)-(4-oxidanylidene-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyrazole-1-carbothioamide

Systemtic Name: N-(4-bromophenyl)-5-methyl-3-oxidanylidene-2-[(Z)-(4-oxidanylidene-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyrazole-1-carbothioamide Openeye Name: N-(4-bromophenyl)-5-methyl-3-oxo-2-[(Z)-(4-oxo-3-phenyl-2-thioxo-thiazolidin-5-ylidene)methyl]pyrazole-1-carbothioamide CAS Name: N-(4-bromophenyl)-5-methyl-3-oxo-2-[(Z)-(4-oxo-3-phenyl-2-sulfanylidene-5-thiazolidinylidene)methyl]-1-pyrazolecarbothioamide IUPAC Name: N-(4-bromophenyl)-5-methyl-3-oxo-2-[(Z)-(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyrazole-1-carbothioamide Traditional Name: N-(4-bromophenyl)-3-keto-2-[(Z)-(4-keto-3-phenyl-2-thioxo-thiazolidin-5-ylidene)methyl]-5-methyl-3-pyrazoline-1-carbothioamide Formula: C21H15BrN4O2S3 MolecularWeight: 531.4684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1C(=S)NC2=CC=C(C=C2)Br)C=C3C(=O)N(C(=S)S3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)N(N1C(=S)NC2=CC=C(C=C2)Br)/C=C\3/C(=O)N(C(=S)S3)C4=CC=CC=C4

InChI

InChI=1S/C21H15BrN4O2S3/c1-13-11-18(27)24(26(13)20(29)23-15-9-7-14(22)8-10-15)12-17-19(28)25(21(30)31-17)16-5-3-2-4-6-16/h2-12H,1H3,(H,23,29)/b17-12-