2-[2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]thiazol-4-yl]acetic acid CAS Name: 2-[2-[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]amino]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[[2-(1,3-benzothiazol-2-ylthio)acetyl]amino]thiazol-4-yl]acetic acid Formula: C14H11N3O3S3 MolecularWeight: 365.45044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NC3=NC(=CS3)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NC3=NC(=CS3)CC(=O)O

InChI

InChI=1S/C14H11N3O3S3/c18-11(17-13-15-8(6-21-13)5-12(19)20)7-22-14-16-9-3-1-2-4-10(9)23-14/h1-4,6H,5,7H2,(H,19,20)(H,15,17,18)