4-chloranyl-N-[[[1-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-chloranyl-N-[[[1-(furan-2-ylmethyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]carbamothioyl]benzamide Openeye Name: 4-chloro-N-[[[1-(2-furylmethyl)-5-oxo-pyrrolidine-3-carbonyl]amino]carbamothioyl]benzamide CAS Name: 4-chloro-N-[[[[1-(2-furanylmethyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-N-[[[1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carbonyl]amino]carbamothioyl]benzamide Traditional Name: 4-chloro-N-[[[1-(2-furfuryl)-5-keto-pyrrolidine-3-carbonyl]amino]thiocarbamoyl]benzamide Formula: C18H17ClN4O4S MolecularWeight: 420.86998

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CC2=CC=CO2)C(=O)NNC(=S)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1C(CN(C1=O)CC2=CC=CO2)C(=O)NNC(=S)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN4O4S/c19-13-5-3-11(4-6-13)16(25)20-18(28)22-21-17(26)12-8-15(24)23(9-12)10-14-2-1-7-27-14/h1-7,12H,8-10H2,(H,21,26)(H2,20,22,25,28)