ethyl 2-[(5-nitrofuran-2-yl)methylideneamino]-4-phenyl-5-thiocyanato-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(5-nitrofuran-2-yl)methylideneamino]-4-phenyl-5-thiocyanato-thiophene-3-carboxylate Openeye Name: ethyl 2-[(5-nitro-2-furyl)methyleneamino]-4-phenyl-5-thiocyanato-thiophene-3-carboxylate CAS Name: 2-[(5-nitro-2-furanyl)methylideneamino]-4-phenyl-5-thiocyanato-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-nitrofuran-2-yl)methylideneamino]-4-phenyl-5-thiocyanatothiophene-3-carboxylate Traditional Name: 2-[(5-nitro-2-furyl)methyleneamino]-4-phenyl-5-thiocyanato-thiophene-3-carboxylic acid ethyl ester Formula: C19H13N3O5S2 MolecularWeight: 427.45362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)SC#N)N=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)SC#N)N=CC3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C19H13N3O5S2/c1-2-26-18(23)16-15(12-6-4-3-5-7-12)19(28-11-20)29-17(16)21-10-13-8-9-14(27-13)22(24)25/h3-10H,2H2,1H3