[2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl] 5-ethyl-4-methyl-thiophene-2-carboxylate

Systemtic Name: [2-(3,3-diphenylpropylamino)-2-oxidanylidene-ethyl] 5-ethyl-4-methyl-thiophene-2-carboxylate Openeye Name: [2-(3,3-diphenylpropylamino)-2-oxo-ethyl] 5-ethyl-4-methyl-thiophene-2-carboxylate CAS Name: 5-ethyl-4-methyl-2-thiophenecarboxylic acid [2-(3,3-diphenylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,3-diphenylpropylamino)-2-oxoethyl] 5-ethyl-4-methylthiophene-2-carboxylate Traditional Name: 5-ethyl-4-methyl-thiophene-2-carboxylic acid [2-(3,3-diphenylpropylamino)-2-keto-ethyl] ester Formula: C25H27NO3S MolecularWeight: 421.55178

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C(=O)OCC(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCC1=C(C=C(S1)C(=O)OCC(=O)NCCC(C2=CC=CC=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C25H27NO3S/c1-3-22-18(2)16-23(30-22)25(28)29-17-24(27)26-15-14-21(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,16,21H,3,14-15,17H2,1-2H3,(H,26,27)