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

Systemtic Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-phenoxyphenyl)ethenyl]sulfanylethanoic acid Openeye Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-phenoxyphenyl)vinyl]sulfanylacetic acid CAS Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-phenoxyphenyl)ethenyl]thio]acetic acid IUPAC Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-phenoxyphenyl)ethenyl]sulfanylacetic acid Traditional Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-phenoxyphenyl)vinyl]thio]acetic acid Formula: C23H17NO3S2 MolecularWeight: 419.51598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C=C(C3=NC4=CC=CC=C4S3)SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)/C=C(/C3=NC4=CC=CC=C4S3)\SCC(=O)O

InChI

InChI=1S/C23H17NO3S2/c25-22(26)15-28-21(23-24-19-11-4-5-12-20(19)29-23)14-16-7-6-10-18(13-16)27-17-8-2-1-3-9-17/h1-14H,15H2,(H,25,26)/b21-14-