methyl 2-[4,5-bis(chloranyl)-2-pentanoylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[4,5-bis(chloranyl)-2-pentanoylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-(4,5-dichloro-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate CAS Name: 2-[4,5-dichloro-2-(1-oxopentylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-(4,5-dichloro-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(4,5-dichloro-2-valerylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C15H16Cl2N2O3S MolecularWeight: 375.27014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N=C1N(C2=C(S1)C=CC(=C2Cl)Cl)CC(=O)OC

Isomeric SMILES

CCCCC(=O)N=C1N(C2=C(S1)C=CC(=C2Cl)Cl)CC(=O)OC

InChI

InChI=1S/C15H16Cl2N2O3S/c1-3-4-5-11(20)18-15-19(8-12(21)22-2)14-10(23-15)7-6-9(16)13(14)17/h6-7H,3-5,8H2,1-2H3