(2S)-2-azanyl-2-(1,3-benzothiazol-2-yl)-4-sulfanyl-butanoic acid

Systemtic Name: (2S)-2-azanyl-2-(1,3-benzothiazol-2-yl)-4-sulfanyl-butanoic acid Openeye Name: (2S)-2-amino-2-(1,3-benzothiazol-2-yl)-4-sulfanyl-butanoic acid CAS Name: (2S)-2-amino-2-(1,3-benzothiazol-2-yl)-4-mercaptobutanoic acid IUPAC Name: (2S)-2-amino-2-(1,3-benzothiazol-2-yl)-4-sulfanylbutanoic acid Traditional Name: (2S)-2-amino-2-(1,3-benzothiazol-2-yl)-4-mercapto-butyric acid Formula: C11H12N2O2S2 MolecularWeight: 268.35518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(CCS)(C(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)[C@](CCS)(C(=O)O)N

InChI

InChI=1S/C11H12N2O2S2/c12-11(5-6-16,10(14)15)9-13-7-3-1-2-4-8(7)17-9/h1-4,16H,5-6,12H2,(H,14,15)/t11-/m1/s1