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

Systemtic Name: 4-(3,4-dimethylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-propan-2-yl-1,3-thiazol-2-imine Openeye Name: 4-(3,4-dimethylphenyl)-N-isopropyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]thiazol-2-imine CAS Name: 4-(3,4-dimethylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-propan-2-yl-2-thiazolimine IUPAC Name: 4-(3,4-dimethylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-propan-2-yl-1,3-thiazol-2-imine Traditional Name: [4-(3,4-dimethylphenyl)-2-isopropylimino-4-thiazolin-3-yl]-[(6-nitro-1,3-benzodioxol-5-yl)methylene]amine Formula: C22H22N4O4S MolecularWeight: 438.49948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=NC(C)C)N2N=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=NC(C)C)N2N=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4)C

InChI

InChI=1S/C22H22N4O4S/c1-13(2)24-22-25(19(11-31-22)16-6-5-14(3)15(4)7-16)23-10-17-8-20-21(30-12-29-20)9-18(17)26(27)28/h5-11,13H,12H2,1-4H3