ethyl 3-(2-pentanoylimino-1,3-benzothiazol-3-yl)propanoate

Systemtic Name: ethyl 3-(2-pentanoylimino-1,3-benzothiazol-3-yl)propanoate Openeye Name: ethyl 3-(2-pentanoylimino-1,3-benzothiazol-3-yl)propanoate CAS Name: 3-[2-(1-oxopentylimino)-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(2-pentanoylimino-1,3-benzothiazol-3-yl)propanoate Traditional Name: 3-(2-valerylimino-1,3-benzothiazol-3-yl)propionic acid ethyl ester Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O3S/c1-3-5-10-15(20)18-17-19(12-11-16(21)22-4-2)13-8-6-7-9-14(13)23-17/h6-9H,3-5,10-12H2,1-2H3