4-(3-bromophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-(4-propan-2-ylphenyl)-1,3-thiazol-2-imine

Systemtic Name: 4-(3-bromophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-(4-propan-2-ylphenyl)-1,3-thiazol-2-imine Openeye Name: 4-(3-bromophenyl)-N-(4-isopropylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]thiazol-2-imine CAS Name: 4-(3-bromophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-(4-propan-2-ylphenyl)-2-thiazolimine IUPAC Name: 4-(3-bromophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-(4-propan-2-ylphenyl)-1,3-thiazol-2-imine Traditional Name: [4-(3-bromophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-thiazolin-2-ylidene]-p-cumenyl-amine Formula: C26H21BrN4O4S MolecularWeight: 565.43834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC(=CC=C3)Br)N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC(=CC=C3)Br)N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

InChI

InChI=1S/C26H21BrN4O4S/c1-16(2)17-6-8-21(9-7-17)29-26-30(23(14-36-26)18-4-3-5-20(27)10-18)28-13-19-11-24-25(35-15-34-24)12-22(19)31(32)33/h3-14,16H,15H2,1-2H3