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

Systemtic Name: 4-(3-chlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-propan-2-yl-1,3-thiazol-2-imine Openeye Name: 4-(3-chlorophenyl)-N-isopropyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]thiazol-2-imine CAS Name: 4-(3-chlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-propan-2-yl-2-thiazolimine IUPAC Name: 4-(3-chlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-propan-2-yl-1,3-thiazol-2-imine Traditional Name: [4-(3-chlorophenyl)-2-isopropylimino-4-thiazolin-3-yl]-[(6-nitro-1,3-benzodioxol-5-yl)methylene]amine Formula: C20H17ClN4O4S MolecularWeight: 444.89138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17ClN4O4S/c1-12(2)23-20-24(17(10-30-20)13-4-3-5-15(21)6-13)22-9-14-7-18-19(29-11-28-18)8-16(14)25(26)27/h3-10,12H,11H2,1-2H3