2-azanyl-3-[(3-chloranyl-1-benzothiophen-2-yl)methylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[(3-chloranyl-1-benzothiophen-2-yl)methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[(3-chlorobenzothiophen-2-yl)methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[(3-chloro-1-benzothiophen-2-yl)methylthio]propanoic acid IUPAC Name: 2-amino-3-[(3-chloro-1-benzothiophen-2-yl)methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[(3-chlorobenzothiophen-2-yl)methylthio]propionic acid Formula: C12H12ClNO2S2 MolecularWeight: 301.81218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)CSCC(C(=O)O)N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)CSCC(C(=O)O)N)Cl

InChI

InChI=1S/C12H12ClNO2S2/c13-11-7-3-1-2-4-9(7)18-10(11)6-17-5-8(14)12(15)16/h1-4,8H,5-6,14H2,(H,15,16)