2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(6-methoxynaphthalen-2-yl)ethenyl]sulfanylethanoic acid

Systemtic Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(6-methoxynaphthalen-2-yl)ethenyl]sulfanylethanoic acid Openeye Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(6-methoxy-2-naphthyl)vinyl]sulfanylacetic acid CAS Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(6-methoxy-2-naphthalenyl)ethenyl]thio]acetic acid IUPAC Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(6-methoxynaphthalen-2-yl)ethenyl]sulfanylacetic acid Traditional Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(6-methoxy-2-naphthyl)vinyl]thio]acetic acid Formula: C22H17NO3S2 MolecularWeight: 407.50528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C=C2)C=C(C3=NC4=CC=CC=C4S3)SCC(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C=C2)/C=C(/C3=NC4=CC=CC=C4S3)\SCC(=O)O

InChI

InChI=1S/C22H17NO3S2/c1-26-17-9-8-15-10-14(6-7-16(15)12-17)11-20(27-13-21(24)25)22-23-18-4-2-3-5-19(18)28-22/h2-12H,13H2,1H3,(H,24,25)/b20-11-