2-(1-benzothiophen-2-ylsulfonylamino)ethyl 3-azanylpropanoate

Systemtic Name: 2-(1-benzothiophen-2-ylsulfonylamino)ethyl 3-azanylpropanoate Openeye Name: 2-(benzothiophen-2-ylsulfonylamino)ethyl 3-aminopropanoate CAS Name: 3-aminopropanoic acid 2-(1-benzothiophen-2-ylsulfonylamino)ethyl ester IUPAC Name: 2-(1-benzothiophen-2-ylsulfonylamino)ethyl 3-aminopropanoate Traditional Name: 3-aminopropionic acid 2-(benzothiophen-2-ylsulfonylamino)ethyl ester Formula: C13H16N2O4S2 MolecularWeight: 328.40714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)S(=O)(=O)NCCOC(=O)CCN

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)S(=O)(=O)NCCOC(=O)CCN

InChI

InChI=1S/C13H16N2O4S2/c14-6-5-12(16)19-8-7-15-21(17,18)13-9-10-3-1-2-4-11(10)20-13/h1-4,9,15H,5-8,14H2