ethyl 2-[6-chloranyl-2-[2-(4-methoxyphenyl)sulfanylethanoylimino]-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-chloranyl-2-[2-(4-methoxyphenyl)sulfanylethanoylimino]-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-chloro-2-[2-(4-methoxyphenyl)sulfanylacetyl]imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-chloro-2-[2-[(4-methoxyphenyl)thio]-1-oxoethyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-chloro-2-[2-(4-methoxyphenyl)sulfanylacetyl]imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-chloro-2-[2-[(4-methoxyphenyl)thio]acetyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C20H19ClN2O4S2 MolecularWeight: 450.95886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)Cl)SC1=NC(=O)CSC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)Cl)SC1=NC(=O)CSC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H19ClN2O4S2/c1-3-27-19(25)11-23-16-9-4-13(21)10-17(16)29-20(23)22-18(24)12-28-15-7-5-14(26-2)6-8-15/h4-10H,3,11-12H2,1-2H3