2-ethylsulfanylethyl (4S,7S)-2-methyl-4-(5-methylfuran-2-yl)-5-oxidanylidene-7-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: 2-ethylsulfanylethyl (4S,7S)-2-methyl-4-(5-methylfuran-2-yl)-5-oxidanylidene-7-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: 2-ethylsulfanylethyl (4S,7S)-2-methyl-4-(5-methyl-2-furyl)-5-oxo-7-(2-thienyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S,7S)-2-methyl-4-(5-methyl-2-furanyl)-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid 2-(ethylthio)ethyl ester IUPAC Name: 2-ethylsulfanylethyl (4S,7S)-2-methyl-4-(5-methylfuran-2-yl)-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S,7S)-5-keto-2-methyl-4-(5-methyl-2-furyl)-7-(2-thienyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid 2-(ethylthio)ethyl ester Formula: C24H27NO4S2 MolecularWeight: 457.60548

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCOC(=O)C1C(C2=C(CC(CC2=O)C3=CC=CS3)N=C1C)C4=CC=C(O4)C

Isomeric SMILES

CCSCCOC(=O)C1[C@@H](C2=C(C[C@@H](CC2=O)C3=CC=CS3)N=C1C)C4=CC=C(O4)C

InChI

InChI=1S/C24H27NO4S2/c1-4-30-11-9-28-24(27)21-15(3)25-17-12-16(20-6-5-10-31-20)13-18(26)22(17)23(21)19-8-7-14(2)29-19/h5-8,10,16,21,23H,4,9,11-13H2,1-3H3/t16-,21?,23-/m0/s1