4-[[(6S)-6-ethyl-3-propan-2-yloxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[(6S)-6-ethyl-3-propan-2-yloxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[(6S)-6-ethyl-3-isopropoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[(6S)-6-ethyl-3-[oxo(propan-2-yloxy)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[(6S)-6-ethyl-3-propan-2-yloxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[(6S)-6-ethyl-3-isopropoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-4-keto-butyric acid Formula: C18H25NO5S MolecularWeight: 367.4598

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)CCC(=O)O

Isomeric SMILES

CC[C@H]1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)CCC(=O)O

InChI

InChI=1S/C18H25NO5S/c1-4-11-5-6-12-13(9-11)25-17(16(12)18(23)24-10(2)3)19-14(20)7-8-15(21)22/h10-11H,4-9H2,1-3H3,(H,19,20)(H,21,22)/t11-/m0/s1