methyl 3-(6-chloranyl-2-propanoylimino-1,3-benzothiazol-3-yl)propanoate

Systemtic Name: methyl 3-(6-chloranyl-2-propanoylimino-1,3-benzothiazol-3-yl)propanoate Openeye Name: methyl 3-(6-chloro-2-propanoylimino-1,3-benzothiazol-3-yl)propanoate CAS Name: 3-[6-chloro-2-(1-oxopropylimino)-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-(6-chloro-2-propanoylimino-1,3-benzothiazol-3-yl)propanoate Traditional Name: 3-(6-chloro-2-propionylimino-1,3-benzothiazol-3-yl)propionic acid methyl ester Formula: C14H15ClN2O3S MolecularWeight: 326.7985

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N=C1N(C2=C(S1)C=C(C=C2)Cl)CCC(=O)OC

Isomeric SMILES

CCC(=O)N=C1N(C2=C(S1)C=C(C=C2)Cl)CCC(=O)OC

InChI

InChI=1S/C14H15ClN2O3S/c1-3-12(18)16-14-17(7-6-13(19)20-2)10-5-4-9(15)8-11(10)21-14/h4-5,8H,3,6-7H2,1-2H3