ethyl 2-[2-(2-oxidanylideneindol-3-yl)hydrazinyl]-4-phenyl-5-thiocyanato-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-oxidanylideneindol-3-yl)hydrazinyl]-4-phenyl-5-thiocyanato-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(2-oxoindol-3-yl)hydrazino]-4-phenyl-5-thiocyanato-thiophene-3-carboxylate CAS Name: 2-[(2-oxo-3-indolyl)hydrazo]-4-phenyl-5-thiocyanato-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(2-oxoindol-3-yl)hydrazinyl]-4-phenyl-5-thiocyanatothiophene-3-carboxylate Traditional Name: 2-[N'-(2-ketoindol-3-yl)hydrazino]-4-phenyl-5-thiocyanato-thiophene-3-carboxylic acid ethyl ester Formula: C22H16N4O3S2 MolecularWeight: 448.51744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)SC#N)NNC3=C4C=CC=CC4=NC3=O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)SC#N)NNC3=C4C=CC=CC4=NC3=O

InChI

InChI=1S/C22H16N4O3S2/c1-2-29-21(28)17-16(13-8-4-3-5-9-13)22(30-12-23)31-20(17)26-25-18-14-10-6-7-11-15(14)24-19(18)27/h3-11,26H,2H2,1H3,(H,24,25,27)