phenethyl 4-oxidanylidene-4-[[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]carbamothioylamino]butanoate

Systemtic Name: phenethyl 4-oxidanylidene-4-[[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]carbamothioylamino]butanoate Openeye Name: phenethyl 4-oxo-4-[[4-[[(2R)-tetrahydrofuran-2-yl]methoxy]phenyl]carbamothioylamino]butanoate CAS Name: 4-oxo-4-[[[4-[[(2R)-2-oxolanyl]methoxy]anilino]-sulfanylidenemethyl]amino]butanoic acid phenethyl ester IUPAC Name: phenethyl 4-oxo-4-[[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]carbamothioylamino]butanoate Traditional Name: 4-keto-4-[[4-[[(2R)-tetrahydrofuran-2-yl]methoxy]phenyl]thiocarbamoylamino]butyric acid phenethyl ester Formula: C24H28N2O5S MolecularWeight: 456.55452

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC=C(C=C2)NC(=S)NC(=O)CCC(=O)OCCC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](OC1)COC2=CC=C(C=C2)NC(=S)NC(=O)CCC(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O5S/c27-22(12-13-23(28)30-16-14-18-5-2-1-3-6-18)26-24(32)25-19-8-10-20(11-9-19)31-17-21-7-4-15-29-21/h1-3,5-6,8-11,21H,4,7,12-17H2,(H2,25,26,27,32)/t21-/m1/s1