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

Systemtic Name: 2-ethylsulfanylethyl (4S,7S)-2-methyl-5-oxidanylidene-7-thiophen-2-yl-4-thiophen-3-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: 2-ethylsulfanylethyl (4S,7S)-2-methyl-5-oxo-7-(2-thienyl)-4-(3-thienyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S,7S)-2-methyl-5-oxo-7-thiophen-2-yl-4-(3-thiophenyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid 2-(ethylthio)ethyl ester IUPAC Name: 2-ethylsulfanylethyl (4S,7S)-2-methyl-5-oxo-7-thiophen-2-yl-4-thiophen-3-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S,7S)-5-keto-2-methyl-7-(2-thienyl)-4-(3-thienyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid 2-(ethylthio)ethyl ester Formula: C23H25NO3S3 MolecularWeight: 459.6445

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25NO3S3/c1-3-28-10-7-27-23(26)20-14(2)24-17-11-16(19-5-4-8-30-19)12-18(25)22(17)21(20)15-6-9-29-13-15/h4-6,8-9,13,16,20-21H,3,7,10-12H2,1-2H3/t16-,20?,21-/m0/s1