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

Systemtic Name: 4-(3,4-dichlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-prop-2-enyl-1,3-thiazol-2-imine Openeye Name: N-allyl-4-(3,4-dichlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]thiazol-2-imine CAS Name: 4-(3,4-dichlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-prop-2-enyl-2-thiazolimine IUPAC Name: 4-(3,4-dichlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-prop-2-enyl-1,3-thiazol-2-imine Traditional Name: allyl-[4-(3,4-dichlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-thiazolin-2-ylidene]amine Formula: C20H14Cl2N4O4S MolecularWeight: 477.32056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14Cl2N4O4S/c1-2-5-23-20-25(17(10-31-20)12-3-4-14(21)15(22)6-12)24-9-13-7-18-19(30-11-29-18)8-16(13)26(27)28/h2-4,6-10H,1,5,11H2