ethyl 2-[2-(hexylcarbamothioylamino)-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-(hexylcarbamothioylamino)-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-(hexylcarbamothioylamino)thiazol-4-yl]acetate CAS Name: 2-[2-[[(hexylamino)-sulfanylidenemethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(hexylcarbamothioylamino)-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-(hexylthiocarbamoylamino)thiazol-4-yl]acetic acid ethyl ester Formula: C14H23N3O2S2 MolecularWeight: 329.48132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=S)NC1=NC(=CS1)CC(=O)OCC

Isomeric SMILES

CCCCCCNC(=S)NC1=NC(=CS1)CC(=O)OCC

InChI

InChI=1S/C14H23N3O2S2/c1-3-5-6-7-8-15-13(20)17-14-16-11(10-21-14)9-12(18)19-4-2/h10H,3-9H2,1-2H3,(H2,15,16,17,20)