4-[[(6R)-3-aminocarbonyl-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[(6R)-3-aminocarbonyl-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[(6R)-3-carbamoyl-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-4-oxo-butanoate CAS Name: 4-[[(6R)-3-carbamoyl-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobutanoate IUPAC Name: 4-[[(6R)-3-carbamoyl-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobutanoate Traditional Name: 4-[[(6R)-3-carbamoyl-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-4-keto-butyrate Formula: C15H19N2O4S- MolecularWeight: 323.38736

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CCC(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O4S/c1-2-8-3-4-9-10(7-8)22-15(13(9)14(16)21)17-11(18)5-6-12(19)20/h8H,2-7H2,1H3,(H2,16,21)(H,17,18)(H,19,20)/p-1/t8-/m1/s1