ethyl 2-(butanoylamino)-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylate

Systemtic Name: ethyl 2-(butanoylamino)-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylate Openeye Name: ethyl 2-(butanoylamino)-4,5-dihydrobenzo[g]benzothiophene-3-carboxylate CAS Name: 2-(1-oxobutylamino)-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(butanoylamino)-4,5-dihydrobenzo[g][1]benzothiole-3-carboxylate Traditional Name: 2-butyramido-4,5-dihydrobenzo[g]benzothiophene-3-carboxylic acid ethyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C2=C(S1)C3=CC=CC=C3CC2)C(=O)OCC

Isomeric SMILES

CCCC(=O)NC1=C(C2=C(S1)C3=CC=CC=C3CC2)C(=O)OCC

InChI

InChI=1S/C19H21NO3S/c1-3-7-15(21)20-18-16(19(22)23-4-2)14-11-10-12-8-5-6-9-13(12)17(14)24-18/h5-6,8-9H,3-4,7,10-11H2,1-2H3,(H,20,21)