ethyl 2-[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(4,4-dimethyl-2,6-dioxo-cyclohexylidene)methylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[(2,6-diketo-4,4-dimethyl-cyclohexylidene)methylamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC=C3C(=O)CC(CC3=O)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC=C3C(=O)CC(CC3=O)(C)C

InChI

InChI=1S/C22H23NO4S/c1-4-27-21(26)15-10-19(14-8-6-5-7-9-14)28-20(15)23-13-16-17(24)11-22(2,3)12-18(16)25/h5-10,13,23H,4,11-12H2,1-3H3