ethyl 2-(cyclohexylcarbamothioylamino)-3-phenyl-propanoate

Systemtic Name: ethyl 2-(cyclohexylcarbamothioylamino)-3-phenyl-propanoate Openeye Name: ethyl 2-(cyclohexylcarbamothioylamino)-3-phenyl-propanoate CAS Name: 2-[[(cyclohexylamino)-sulfanylidenemethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-(cyclohexylcarbamothioylamino)-3-phenylpropanoate Traditional Name: 2-(cyclohexylthiocarbamoylamino)-3-phenyl-propionic acid ethyl ester Formula: C18H26N2O2S MolecularWeight: 334.47624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=S)NC2CCCCC2

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)NC(=S)NC2CCCCC2

InChI

InChI=1S/C18H26N2O2S/c1-2-22-17(21)16(13-14-9-5-3-6-10-14)20-18(23)19-15-11-7-4-8-12-15/h3,5-6,9-10,15-16H,2,4,7-8,11-13H2,1H3,(H2,19,20,23)