3-(2-chlorophenyl)-N-[[[1-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]carbamothioyl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[[[1-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[[[1-(2-furylmethyl)-5-oxo-pyrrolidine-3-carbonyl]amino]carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[[[1-(2-furanylmethyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[[[1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carbonyl]amino]carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[[[1-(2-furfuryl)-5-keto-pyrrolidine-3-carbonyl]amino]thiocarbamoyl]propionamide Formula: C20H21ClN4O4S MolecularWeight: 448.92314

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CC2=CC=CO2)C(=O)NNC(=S)NC(=O)CCC3=CC=CC=C3Cl

Isomeric SMILES

C1C(CN(C1=O)CC2=CC=CO2)C(=O)NNC(=S)NC(=O)CCC3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN4O4S/c21-16-6-2-1-4-13(16)7-8-17(26)22-20(30)24-23-19(28)14-10-18(27)25(11-14)12-15-5-3-9-29-15/h1-6,9,14H,7-8,10-12H2,(H,23,28)(H2,22,24,26,30)