3-[(5-nitrofuran-2-yl)methylideneamino]-N-prop-2-enyl-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-imine

Systemtic Name: 3-[(5-nitrofuran-2-yl)methylideneamino]-N-prop-2-enyl-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-imine Openeye Name: N-allyl-3-[(5-nitro-2-furyl)methyleneamino]-4-(3,4,5-trimethoxyphenyl)thiazol-2-imine CAS Name: 3-[(5-nitro-2-furanyl)methylideneamino]-N-prop-2-enyl-4-(3,4,5-trimethoxyphenyl)-2-thiazolimine IUPAC Name: 3-[(5-nitrofuran-2-yl)methylideneamino]-N-prop-2-enyl-4-(3,4,5-trimethoxyphenyl)-1,3-thiazol-2-imine Traditional Name: allyl-[3-[(5-nitro-2-furyl)methyleneamino]-4-(3,4,5-trimethoxyphenyl)-4-thiazolin-2-ylidene]amine Formula: C20H20N4O6S MolecularWeight: 444.461

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=CSC(=NCC=C)N2N=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CSC(=NCC=C)N2N=CC3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O6S/c1-5-8-21-20-23(22-11-14-6-7-18(30-14)24(25)26)15(12-31-20)13-9-16(27-2)19(29-4)17(10-13)28-3/h5-7,9-12H,1,8H2,2-4H3