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

Systemtic Name: N-(4-methylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-thiophen-2-yl-1,3-thiazol-2-imine Openeye Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-N-(p-tolyl)-4-(2-thienyl)thiazol-2-imine CAS Name: N-(4-methylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-thiophen-2-yl-2-thiazolimine IUPAC Name: N-(4-methylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-thiophen-2-yl-1,3-thiazol-2-imine Traditional Name: (6-nitro-1,3-benzodioxol-5-yl)methylene-[2-(p-tolylimino)-4-(2-thienyl)-4-thiazolin-3-yl]amine Formula: C22H16N4O4S2 MolecularWeight: 464.51684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC=CS3)N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

Isomeric SMILES

CC1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC=CS3)N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

InChI

InChI=1S/C22H16N4O4S2/c1-14-4-6-16(7-5-14)24-22-25(18(12-32-22)21-3-2-8-31-21)23-11-15-9-19-20(30-13-29-19)10-17(15)26(27)28/h2-12H,13H2,1H3