2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-thiophen-3-yl-ethenyl]sulfanylethanoic acid

Systemtic Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-thiophen-3-yl-ethenyl]sulfanylethanoic acid Openeye Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-thienyl)vinyl]sulfanylacetic acid CAS Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-thiophenyl)ethenyl]thio]acetic acid IUPAC Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-thiophen-3-ylethenyl]sulfanylacetic acid Traditional Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-thienyl)vinyl]thio]acetic acid Formula: C15H11NO2S3 MolecularWeight: 333.44834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=CC3=CSC=C3)SCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)/C(=C/C3=CSC=C3)/SCC(=O)O

InChI

InChI=1S/C15H11NO2S3/c17-14(18)9-20-13(7-10-5-6-19-8-10)15-16-11-3-1-2-4-12(11)21-15/h1-8H,9H2,(H,17,18)/b13-7-