[2-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-2-oxidanylidene-ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate

Systemtic Name: [2-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-2-oxidanylidene-ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate Openeye Name: [2-[[(4S)-chroman-4-yl]amino]-2-oxo-ethyl] 5-methyl-4-propyl-thiophene-2-carboxylate CAS Name: 5-methyl-4-propyl-2-thiophenecarboxylic acid [2-[[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-2-oxoethyl] 5-methyl-4-propylthiophene-2-carboxylate Traditional Name: 5-methyl-4-propyl-thiophene-2-carboxylic acid [2-[[(4S)-chroman-4-yl]amino]-2-keto-ethyl] ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SC(=C1)C(=O)OCC(=O)NC2CCOC3=CC=CC=C23)C

Isomeric SMILES

CCCC1=C(SC(=C1)C(=O)OCC(=O)N[C@H]2CCOC3=CC=CC=C23)C

InChI

InChI=1S/C20H23NO4S/c1-3-6-14-11-18(26-13(14)2)20(23)25-12-19(22)21-16-9-10-24-17-8-5-4-7-15(16)17/h4-5,7-8,11,16H,3,6,9-10,12H2,1-2H3,(H,21,22)/t16-/m0/s1