N-[2,5-diethoxy-4-(2-methylpropylcarbamothioylamino)phenyl]furan-2-carboxamide

Systemtic Name: N-[2,5-diethoxy-4-(2-methylpropylcarbamothioylamino)phenyl]furan-2-carboxamide Openeye Name: N-[2,5-diethoxy-4-(isobutylcarbamothioylamino)phenyl]furan-2-carboxamide CAS Name: N-[2,5-diethoxy-4-[[(2-methylpropylamino)-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[2,5-diethoxy-4-(2-methylpropylcarbamothioylamino)phenyl]furan-2-carboxamide Traditional Name: N-[2,5-diethoxy-4-(isobutylthiocarbamoylamino)phenyl]-2-furamide Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CO2)OCC)NC(=S)NCC(C)C

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CO2)OCC)NC(=S)NCC(C)C

InChI

InChI=1S/C20H27N3O4S/c1-5-25-17-11-15(23-20(28)21-12-13(3)4)18(26-6-2)10-14(17)22-19(24)16-8-7-9-27-16/h7-11,13H,5-6,12H2,1-4H3,(H,22,24)(H2,21,23,28)