N-[3-[(2-hexoxyphenyl)carbonylcarbamothioylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[(2-hexoxyphenyl)carbonylcarbamothioylamino]phenyl]furan-2-carboxamide Openeye Name: N-[3-[(2-hexoxybenzoyl)carbamothioylamino]phenyl]furan-2-carboxamide CAS Name: N-[3-[[[[(2-hexoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[3-[(2-hexoxybenzoyl)carbamothioylamino]phenyl]furan-2-carboxamide Traditional Name: N-[3-[(2-hexoxybenzoyl)thiocarbamoylamino]phenyl]-2-furamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C25H27N3O4S/c1-2-3-4-7-15-31-21-13-6-5-12-20(21)23(29)28-25(33)27-19-11-8-10-18(17-19)26-24(30)22-14-9-16-32-22/h5-6,8-14,16-17H,2-4,7,15H2,1H3,(H,26,30)(H2,27,28,29,33)