ethyl 2-(2-chloranylethanoylamino)-4-phenyl-5-thiocyanato-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(2-chloranylethanoylamino)-4-phenyl-5-thiocyanato-thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-chloroacetyl)amino]-4-phenyl-5-thiocyanato-thiophene-3-carboxylate CAS Name: 2-[(2-chloro-1-oxoethyl)amino]-4-phenyl-5-thiocyanato-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-chloroacetyl)amino]-4-phenyl-5-thiocyanatothiophene-3-carboxylate Traditional Name: 2-[(2-chloroacetyl)amino]-4-phenyl-5-thiocyanato-thiophene-3-carboxylic acid ethyl ester Formula: C16H13ClN2O3S2 MolecularWeight: 380.86902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)SC#N)NC(=O)CCl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)SC#N)NC(=O)CCl

InChI

InChI=1S/C16H13ClN2O3S2/c1-2-22-15(21)13-12(10-6-4-3-5-7-10)16(23-9-18)24-14(13)19-11(20)8-17/h3-7H,2,8H2,1H3,(H,19,20)