ethyl 2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylimino]-6-ethoxy-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylimino]-6-ethoxy-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-(3-chlorobenzothiophene-2-carbonyl)imino-6-ethoxy-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]imino-6-ethoxy-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-chloro-1-benzothiophene-2-carbonyl)imino-6-ethoxy-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(3-chlorobenzothiophene-2-carbonyl)imino-6-ethoxy-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C22H19ClN2O4S2 MolecularWeight: 474.98026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=C(C4=CC=CC=C4S3)Cl)S2)CC(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=C(C4=CC=CC=C4S3)Cl)S2)CC(=O)OCC

InChI

InChI=1S/C22H19ClN2O4S2/c1-3-28-13-9-10-15-17(11-13)31-22(25(15)12-18(26)29-4-2)24-21(27)20-19(23)14-7-5-6-8-16(14)30-20/h5-11H,3-4,12H2,1-2H3