phenethyl 4-(cyclohexylcarbamothioylamino)-4-oxidanylidene-butanoate

Systemtic Name: phenethyl 4-(cyclohexylcarbamothioylamino)-4-oxidanylidene-butanoate Openeye Name: phenethyl 4-(cyclohexylcarbamothioylamino)-4-oxo-butanoate CAS Name: 4-[[(cyclohexylamino)-sulfanylidenemethyl]amino]-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-(cyclohexylcarbamothioylamino)-4-oxobutanoate Traditional Name: 4-(cyclohexylthiocarbamoylamino)-4-keto-butyric acid phenethyl ester Formula: C19H26N2O3S MolecularWeight: 362.48634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC(=O)CCC(=O)OCCC2=CC=CC=C2

Isomeric SMILES

C1CCC(CC1)NC(=S)NC(=O)CCC(=O)OCCC2=CC=CC=C2

InChI

InChI=1S/C19H26N2O3S/c22-17(21-19(25)20-16-9-5-2-6-10-16)11-12-18(23)24-14-13-15-7-3-1-4-8-15/h1,3-4,7-8,16H,2,5-6,9-14H2,(H2,20,21,22,25)