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

Systemtic Name: cyclopentyl (4R,4aS,7S)-2-methyl-5-oxidanylidene-4,7-dithiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: cyclopentyl (4R,4aS,7S)-2-methyl-5-oxo-4,7-bis(2-thienyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4R,4aS,7S)-2-methyl-5-oxo-4,7-dithiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid cyclopentyl ester IUPAC Name: cyclopentyl (4R,4aS,7S)-2-methyl-5-oxo-4,7-dithiophen-2-yl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4R,4aS,7S)-5-keto-2-methyl-4,7-bis(2-thienyl)-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid cyclopentyl ester Formula: C24H25NO3S2 MolecularWeight: 439.5902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=N1)CC(CC2=O)C3=CC=CS3)C4=CC=CS4)C(=O)OC5CCCC5

Isomeric SMILES

CC1=C([C@@H]([C@H]2C(=N1)C[C@@H](CC2=O)C3=CC=CS3)C4=CC=CS4)C(=O)OC5CCCC5

InChI

InChI=1S/C24H25NO3S2/c1-14-21(24(27)28-16-6-2-3-7-16)23(20-9-5-11-30-20)22-17(25-14)12-15(13-18(22)26)19-8-4-10-29-19/h4-5,8-11,15-16,22-23H,2-3,6-7,12-13H2,1H3/t15-,22-,23-/m0/s1