1,3-benzothiazol-2-ylmethyl 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-[(8-chloro-1-naphthyl)sulfanyl]acetate CAS Name: 2-[(8-chloro-1-naphthalenyl)thio]acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-(8-chloronaphthalen-1-yl)sulfanylacetate Traditional Name: 2-[(8-chloro-1-naphthyl)thio]acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C20H14ClNO2S2 MolecularWeight: 399.91366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COC(=O)CSC3=CC=CC4=C3C(=CC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COC(=O)CSC3=CC=CC4=C3C(=CC=C4)Cl

InChI

InChI=1S/C20H14ClNO2S2/c21-14-7-3-5-13-6-4-10-17(20(13)14)25-12-19(23)24-11-18-22-15-8-1-2-9-16(15)26-18/h1-10H,11-12H2