4-oxidanylidene-4-[[3-(oxolan-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[3-(oxolan-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]butanoic acid Openeye Name: 4-oxo-4-[[3-(tetrahydrofuran-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]butanoic acid CAS Name: 4-oxo-4-[[3-[oxo-(2-oxolanylmethylamino)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]butanoic acid IUPAC Name: 4-oxo-4-[[3-(oxolan-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]butanoic acid Traditional Name: 4-keto-4-[[3-(tetrahydrofurfurylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]butyric acid Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CCC(=O)O)C(=O)NCC3CCCO3

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CCC(=O)O)C(=O)NCC3CCCO3

InChI

InChI=1S/C18H24N2O5S/c21-14(7-8-15(22)23)20-18-16(12-5-1-2-6-13(12)26-18)17(24)19-10-11-4-3-9-25-11/h11H,1-10H2,(H,19,24)(H,20,21)(H,22,23)