methyl (2R)-4-methylsulfanyl-2-[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]butanoate

Systemtic Name: methyl (2R)-4-methylsulfanyl-2-[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbonylamino]butanoate Openeye Name: methyl (2R)-4-methylsulfanyl-2-[[(5S)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]butanoate CAS Name: (2R)-2-[[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-4-methylsulfanyl-2-[[(5S)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl]amino]butanoate Traditional Name: (2R)-2-[[(5S)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C16H23NO3S2 MolecularWeight: 341.48872

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)N[C@H](CCSC)C(=O)OC

InChI

InChI=1S/C16H23NO3S2/c1-10-4-5-13-11(8-10)9-14(22-13)15(18)17-12(6-7-21-3)16(19)20-2/h9-10,12H,4-8H2,1-3H3,(H,17,18)/t10-,12+/m0/s1