ethyl 2-(4-methyl-2-pentanoylimino-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: ethyl 2-(4-methyl-2-pentanoylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: ethyl 2-(4-methyl-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate CAS Name: 2-[4-methyl-2-(1-oxopentylimino)-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-(4-methyl-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(4-methyl-2-valerylimino-1,3-benzothiazol-3-yl)acetic acid ethyl ester Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N=C1N(C2=C(C=CC=C2S1)C)CC(=O)OCC

Isomeric SMILES

CCCCC(=O)N=C1N(C2=C(C=CC=C2S1)C)CC(=O)OCC

InChI

InChI=1S/C17H22N2O3S/c1-4-6-10-14(20)18-17-19(11-15(21)22-5-2)16-12(3)8-7-9-13(16)23-17/h7-9H,4-6,10-11H2,1-3H3