quinolin-8-ylmethyl 2-(2,2-dimethylpropanoylamino)-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: quinolin-8-ylmethyl 2-(2,2-dimethylpropanoylamino)-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: 8-quinolylmethyl 2-(2,2-dimethylpropanoylamino)-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-4,5-dimethyl-3-thiophenecarboxylic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 2-(2,2-dimethylpropanoylamino)-4,5-dimethylthiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-(pivaloylamino)thiophene-3-carboxylic acid 8-quinolylmethyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCC2=CC=CC3=C2N=CC=C3)NC(=O)C(C)(C)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCC2=CC=CC3=C2N=CC=C3)NC(=O)C(C)(C)C)C

InChI

InChI=1S/C22H24N2O3S/c1-13-14(2)28-19(24-21(26)22(3,4)5)17(13)20(25)27-12-16-9-6-8-15-10-7-11-23-18(15)16/h6-11H,12H2,1-5H3,(H,24,26)