ethyl 2-(6-methylsulfanyl-2-pentanoylimino-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: ethyl 2-(6-methylsulfanyl-2-pentanoylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: ethyl 2-(6-methylsulfanyl-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate CAS Name: 2-[6-(methylthio)-2-(1-oxopentylimino)-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-(6-methylsulfanyl-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-[6-(methylthio)-2-valerylimino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C17H22N2O3S2 MolecularWeight: 366.49818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N=C1N(C2=C(S1)C=C(C=C2)SC)CC(=O)OCC

Isomeric SMILES

CCCCC(=O)N=C1N(C2=C(S1)C=C(C=C2)SC)CC(=O)OCC

InChI

InChI=1S/C17H22N2O3S2/c1-4-6-7-15(20)18-17-19(11-16(21)22-5-2)13-9-8-12(23-3)10-14(13)24-17/h8-10H,4-7,11H2,1-3H3