methyl 2-(6-ethoxy-2-pentanoylimino-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: methyl 2-(6-ethoxy-2-pentanoylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: methyl 2-(6-ethoxy-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate CAS Name: 2-[6-ethoxy-2-(1-oxopentylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-(6-ethoxy-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(6-ethoxy-2-valerylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O4S/c1-4-6-7-15(20)18-17-19(11-16(21)22-3)13-9-8-12(23-5-2)10-14(13)24-17/h8-10H,4-7,11H2,1-3H3