(Z)-5-(4-bromophenyl)-3-methylsulfanyl-5-oxidanylidene-2-(2-phenyl-1,3-thiazol-4-yl)pent-2-enenitrile

Systemtic Name: (Z)-5-(4-bromophenyl)-3-methylsulfanyl-5-oxidanylidene-2-(2-phenyl-1,3-thiazol-4-yl)pent-2-enenitrile Openeye Name: (Z)-5-(4-bromophenyl)-3-methylsulfanyl-5-oxo-2-(2-phenylthiazol-4-yl)pent-2-enenitrile CAS Name: (Z)-5-(4-bromophenyl)-3-(methylthio)-5-oxo-2-(2-phenyl-4-thiazolyl)-2-pentenenitrile IUPAC Name: (Z)-5-(4-bromophenyl)-3-methylsulfanyl-5-oxo-2-(2-phenyl-1,3-thiazol-4-yl)pent-2-enenitrile Traditional Name: (Z)-5-(4-bromophenyl)-5-keto-3-(methylthio)-2-(2-phenylthiazol-4-yl)pent-2-enenitrile Formula: C21H15BrN2OS2 MolecularWeight: 455.3906

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C#N)C1=CSC(=N1)C2=CC=CC=C2)CC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CS/C(=C(\C#N)/C1=CSC(=N1)C2=CC=CC=C2)/CC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H15BrN2OS2/c1-26-20(11-19(25)14-7-9-16(22)10-8-14)17(12-23)18-13-27-21(24-18)15-5-3-2-4-6-15/h2-10,13H,11H2,1H3/b20-17+