4-methylsulfanyl-2-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)butanoic acid

Systemtic Name: 4-methylsulfanyl-2-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)butanoic acid Openeye Name: 4-methylsulfanyl-2-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)butanoic acid CAS Name: 4-(methylthio)-2-[[oxo(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)methyl]amino]butanoic acid IUPAC Name: 4-methylsulfanyl-2-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)butanoic acid Traditional Name: 4-(methylthio)-2-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)butyric acid Formula: C15H21NO3S2 MolecularWeight: 327.46214

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1=CC2=C(S1)CCCCC2

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)C1=CC2=C(S1)CCCCC2

InChI

InChI=1S/C15H21NO3S2/c1-20-8-7-11(15(18)19)16-14(17)13-9-10-5-3-2-4-6-12(10)21-13/h9,11H,2-8H2,1H3,(H,16,17)(H,18,19)