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

Systemtic Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-naphthalen-2-yl-ethenyl]sulfanylethanoic acid Openeye Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(2-naphthyl)vinyl]sulfanylacetic acid CAS Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(2-naphthalenyl)ethenyl]thio]acetic acid IUPAC Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-naphthalen-2-ylethenyl]sulfanylacetic acid Traditional Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(2-naphthyl)vinyl]thio]acetic acid Formula: C21H15NO2S2 MolecularWeight: 377.4793

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C=C(C3=NC4=CC=CC=C4S3)SCC(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)/C=C(/C3=NC4=CC=CC=C4S3)\SCC(=O)O

InChI

InChI=1S/C21H15NO2S2/c23-20(24)13-25-19(21-22-17-7-3-4-8-18(17)26-21)12-14-9-10-15-5-1-2-6-16(15)11-14/h1-12H,13H2,(H,23,24)/b19-12-