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

Systemtic Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-(4-nitrophenyl)-N-prop-2-enyl-1,3-thiazol-2-imine Openeye Name: N-allyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-(4-nitrophenyl)thiazol-2-imine CAS Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-(4-nitrophenyl)-N-prop-2-enyl-2-thiazolimine IUPAC Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-(4-nitrophenyl)-N-prop-2-enyl-1,3-thiazol-2-imine Traditional Name: allyl-[3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-(4-nitrophenyl)-4-thiazolin-2-ylidene]amine Formula: C20H15N5O6S MolecularWeight: 453.428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15N5O6S/c1-2-7-21-20-23(17(11-32-20)13-3-5-15(6-4-13)24(26)27)22-10-14-8-18-19(31-12-30-18)9-16(14)25(28)29/h2-6,8-11H,1,7,12H2