N-[3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]furan-2-carboxamide Openeye Name: N-[3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]furan-2-carboxamide CAS Name: N-[3-[[[[3-(2-chlorophenyl)-1-oxopropyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]furan-2-carboxamide Traditional Name: N-[3-[3-(2-chlorophenyl)propanoylthiocarbamoylamino]phenyl]-2-furamide Formula: C21H18ClN3O3S MolecularWeight: 427.90392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCC(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CO3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CCC(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CO3)Cl

InChI

InChI=1S/C21H18ClN3O3S/c22-17-8-2-1-5-14(17)10-11-19(26)25-21(29)24-16-7-3-6-15(13-16)23-20(27)18-9-4-12-28-18/h1-9,12-13H,10-11H2,(H,23,27)(H2,24,25,26,29)