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

Systemtic Name: N-(2,3-dimethylphenyl)-4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine Openeye Name: N-(2,3-dimethylphenyl)-4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]thiazol-2-imine CAS Name: N-(2,3-dimethylphenyl)-4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-thiazolimine IUPAC Name: N-(2,3-dimethylphenyl)-4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine Traditional Name: (2,3-dimethylphenyl)-[4-methyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-thiazolin-2-ylidene]amine Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N=C2N(C(=CS2)C)N=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N=C2N(C(=CS2)C)N=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4)C

InChI

InChI=1S/C20H18N4O4S/c1-12-5-4-6-16(14(12)3)22-20-23(13(2)10-29-20)21-9-15-7-18-19(28-11-27-18)8-17(15)24(25)26/h4-10H,11H2,1-3H3