3-[1-[2-[4-(2-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanylpropylcarbamoyl]oxirane-2-carboxylate

Systemtic Name: 3-[1-[2-[4-(2-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanylpropylcarbamoyl]oxirane-2-carboxylate Openeye Name: 3-[1-[2-[4-(2-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]sulfanylpropylcarbamoyl]oxirane-2-carboxylate CAS Name: 3-[[1-[[2-[4-(2-chlorophenyl)-1-piperazinyl]-2-oxoethyl]thio]propylamino]-oxomethyl]-2-oxiranecarboxylate IUPAC Name: 3-[1-[2-[4-(2-chlorophenyl)piperazin-1-yl]-2-oxoethyl]sulfanylpropylcarbamoyl]oxirane-2-carboxylate Traditional Name: 3-[1-[[2-[4-(2-chlorophenyl)piperazino]-2-keto-ethyl]thio]propylcarbamoyl]oxirane-2-carboxylate Formula: C19H23ClN3O5S- MolecularWeight: 440.92102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(NC(=O)C1C(O1)C(=O)[O-])SCC(=O)N2CCN(CC2)C3=CC=CC=C3Cl

Isomeric SMILES

CCC(NC(=O)C1C(O1)C(=O)[O-])SCC(=O)N2CCN(CC2)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H24ClN3O5S/c1-2-14(21-18(25)16-17(28-16)19(26)27)29-11-15(24)23-9-7-22(8-10-23)13-6-4-3-5-12(13)20/h3-6,14,16-17H,2,7-11H2,1H3,(H,21,25)(H,26,27)/p-1