(4-oxidanylidene-4-thiophen-2-yl-butyl) (3R)-3-(aminocarbonylamino)-3-(4-chlorophenyl)propanoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) (3R)-3-(aminocarbonylamino)-3-(4-chlorophenyl)propanoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] (3R)-3-(4-chlorophenyl)-3-ureido-propanoate CAS Name: (3R)-3-(carbamoylamino)-3-(4-chlorophenyl)propanoic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) (3R)-3-(carbamoylamino)-3-(4-chlorophenyl)propanoate Traditional Name: (3R)-3-(4-chlorophenyl)-3-ureido-propionic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C18H19ClN2O4S MolecularWeight: 394.87246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)CCCOC(=O)CC(C2=CC=C(C=C2)Cl)NC(=O)N

Isomeric SMILES

C1=CSC(=C1)C(=O)CCCOC(=O)C[C@H](C2=CC=C(C=C2)Cl)NC(=O)N

InChI

InChI=1S/C18H19ClN2O4S/c19-13-7-5-12(6-8-13)14(21-18(20)24)11-17(23)25-9-1-3-15(22)16-4-2-10-26-16/h2,4-8,10,14H,1,3,9,11H2,(H3,20,21,24)/t14-/m1/s1