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

Systemtic Name: N-(4-chlorophenyl)-4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine Openeye Name: N-(4-chlorophenyl)-4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]thiazol-2-imine CAS Name: N-(4-chlorophenyl)-4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-thiazolimine IUPAC Name: N-(4-chlorophenyl)-4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine Traditional Name: (4-chlorophenyl)-[4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-thiazolin-2-ylidene]amine Formula: C18H13ClN4O4S MolecularWeight: 416.83822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=NC2=CC=C(C=C2)Cl)N1N=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

CC1=CSC(=NC2=CC=C(C=C2)Cl)N1N=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C18H13ClN4O4S/c1-11-9-28-18(21-14-4-2-13(19)3-5-14)22(11)20-8-12-6-16-17(27-10-26-16)7-15(12)23(24)25/h2-9H,10H2,1H3