methyl 2-[2-(5-chloranylthiophen-2-yl)carbonylimino-6-ethoxy-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(5-chloranylthiophen-2-yl)carbonylimino-6-ethoxy-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(5-chlorothiophene-2-carbonyl)imino-6-ethoxy-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(5-chloro-2-thiophenyl)-oxomethyl]imino-6-ethoxy-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(5-chlorothiophene-2-carbonyl)imino-6-ethoxy-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(5-chlorothiophene-2-carbonyl)imino-6-ethoxy-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C17H15ClN2O4S2 MolecularWeight: 410.895

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(S3)Cl)S2)CC(=O)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(S3)Cl)S2)CC(=O)OC

InChI

InChI=1S/C17H15ClN2O4S2/c1-3-24-10-4-5-11-13(8-10)26-17(20(11)9-15(21)23-2)19-16(22)12-6-7-14(18)25-12/h4-8H,3,9H2,1-2H3