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

Systemtic Name: cyclopentyl (4S,7S)-2-methyl-4-(5-methylthiophen-2-yl)-5-oxidanylidene-7-thiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: cyclopentyl (4S,7S)-2-methyl-4-(5-methyl-2-thienyl)-5-oxo-7-(2-thienyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4S,7S)-2-methyl-4-(5-methyl-2-thiophenyl)-5-oxo-7-thiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid cyclopentyl ester IUPAC Name: cyclopentyl (4S,7S)-2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-7-thiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4S,7S)-5-keto-2-methyl-4-(5-methyl-2-thienyl)-7-(2-thienyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid cyclopentyl ester Formula: C25H27NO3S2 MolecularWeight: 453.61678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2C3C(=NC(=C2C(=O)OC4CCCC4)C)CC(CC3=O)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(S1)[C@H]2C3C(=NC(=C2C(=O)OC4CCCC4)C)C[C@@H](CC3=O)C5=CC=CS5

InChI

InChI=1S/C25H27NO3S2/c1-14-9-10-21(31-14)24-22(25(28)29-17-6-3-4-7-17)15(2)26-18-12-16(13-19(27)23(18)24)20-8-5-11-30-20/h5,8-11,16-17,23-24H,3-4,6-7,12-13H2,1-2H3/t16-,23?,24+/m0/s1