propan-2-yl 4-(phenylcarbamothioylamino)butanoate

Systemtic Name: propan-2-yl 4-(phenylcarbamothioylamino)butanoate Openeye Name: isopropyl 4-(phenylcarbamothioylamino)butanoate CAS Name: 4-[[anilino(sulfanylidene)methyl]amino]butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(phenylcarbamothioylamino)butanoate Traditional Name: 4-(phenylthiocarbamoylamino)butyric acid isopropyl ester Formula: C14H20N2O2S MolecularWeight: 280.3858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCCNC(=S)NC1=CC=CC=C1

Isomeric SMILES

CC(C)OC(=O)CCCNC(=S)NC1=CC=CC=C1

InChI

InChI=1S/C14H20N2O2S/c1-11(2)18-13(17)9-6-10-15-14(19)16-12-7-4-3-5-8-12/h3-5,7-8,11H,6,9-10H2,1-2H3,(H2,15,16,19)