N-(2-methylprop-2-enyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-1,3-thiazol-2-imine

Systemtic Name: N-(2-methylprop-2-enyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-1,3-thiazol-2-imine Openeye Name: N-(2-methylallyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-phenyl-thiazol-2-imine CAS Name: N-(2-methylprop-2-enyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-2-thiazolimine IUPAC Name: N-(2-methylprop-2-enyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-1,3-thiazol-2-imine Traditional Name: 2-methylallyl-[3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-phenyl-4-thiazolin-2-ylidene]amine Formula: C21H18N4O4S MolecularWeight: 422.45702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN=C1N(C(=CS1)C2=CC=CC=C2)N=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

CC(=C)CN=C1N(C(=CS1)C2=CC=CC=C2)N=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C21H18N4O4S/c1-14(2)10-22-21-24(18(12-30-21)15-6-4-3-5-7-15)23-11-16-8-19-20(29-13-28-19)9-17(16)25(26)27/h3-9,11-12H,1,10,13H2,2H3