methyl 3-[2-(5-chloranylthiophen-2-yl)carbonylimino-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: methyl 3-[2-(5-chloranylthiophen-2-yl)carbonylimino-1,3-benzothiazol-3-yl]propanoate Openeye Name: methyl 3-[2-(5-chlorothiophene-2-carbonyl)imino-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[(5-chloro-2-thiophenyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(5-chlorothiophene-2-carbonyl)imino-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-(5-chlorothiophene-2-carbonyl)imino-1,3-benzothiazol-3-yl]propionic acid methyl ester Formula: C16H13ClN2O3S2 MolecularWeight: 380.86902

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C2=CC=CC=C2SC1=NC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

COC(=O)CCN1C2=CC=CC=C2SC1=NC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H13ClN2O3S2/c1-22-14(20)8-9-19-10-4-2-3-5-11(10)24-16(19)18-15(21)12-6-7-13(17)23-12/h2-7H,8-9H2,1H3