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

Systemtic Name: methyl (4S)-2-methyl-4-(5-methyl-2-methylsulfanyl-thiophen-3-yl)-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: methyl (4S)-2-methyl-4-(5-methyl-2-methylsulfanyl-3-thienyl)-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4S)-2-methyl-4-[5-methyl-2-(methylthio)-3-thiophenyl]-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-2-methyl-4-(5-methyl-2-methylsulfanylthiophen-3-yl)-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4S)-5-keto-2-methyl-4-[5-methyl-2-(methylthio)-3-thienyl]-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid methyl ester Formula: C18H21NO3S2 MolecularWeight: 363.49424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)SC)C2C3C(=NC(=C2C(=O)OC)C)CCCC3=O

Isomeric SMILES

CC1=CC(=C(S1)SC)[C@H]2C3C(=NC(=C2C(=O)OC)C)CCCC3=O

InChI

InChI=1S/C18H21NO3S2/c1-9-8-11(18(23-4)24-9)15-14(17(21)22-3)10(2)19-12-6-5-7-13(20)16(12)15/h8,15-16H,5-7H2,1-4H3/t15-,16?/m1/s1