3-(4-bromophenyl)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(4-bromophenyl)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-propanenitrile Openeye Name: 3-(4-bromophenyl)-2-[4-(3-nitrophenyl)thiazol-2-yl]-3-oxo-propanenitrile CAS Name: 3-(4-bromophenyl)-2-[4-(3-nitrophenyl)-2-thiazolyl]-3-oxopropanenitrile IUPAC Name: 3-(4-bromophenyl)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-oxopropanenitrile Traditional Name: 3-(4-bromophenyl)-3-keto-2-[4-(3-nitrophenyl)thiazol-2-yl]propionitrile Formula: C18H10BrN3O3S MolecularWeight: 428.2593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)C(C#N)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)C(C#N)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H10BrN3O3S/c19-13-6-4-11(5-7-13)17(23)15(9-20)18-21-16(10-26-18)12-2-1-3-14(8-12)22(24)25/h1-8,10,15H