2-[2-[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl]sulfanyl-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl]sulfanyl-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[2-oxo-2-(3-phenylsulfanylpropylamino)ethyl]sulfanylthiazol-4-yl]acetic acid CAS Name: 2-[2-[[2-oxo-2-[3-(phenylthio)propylamino]ethyl]thio]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[2-oxo-2-(3-phenylsulfanylpropylamino)ethyl]sulfanyl-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[[2-keto-2-[3-(phenylthio)propylamino]ethyl]thio]thiazol-4-yl]acetic acid Formula: C16H18N2O3S3 MolecularWeight: 382.52072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCNC(=O)CSC2=NC(=CS2)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SCCCNC(=O)CSC2=NC(=CS2)CC(=O)O

InChI

InChI=1S/C16H18N2O3S3/c19-14(11-24-16-18-12(10-23-16)9-15(20)21)17-7-4-8-22-13-5-2-1-3-6-13/h1-3,5-6,10H,4,7-9,11H2,(H,17,19)(H,20,21)