N-[3-[(3-butoxyphenyl)carbonylcarbamothioylamino]-4-methyl-phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[(3-butoxyphenyl)carbonylcarbamothioylamino]-4-methyl-phenyl]furan-2-carboxamide Openeye Name: N-[3-[(3-butoxybenzoyl)carbamothioylamino]-4-methyl-phenyl]furan-2-carboxamide CAS Name: N-[3-[[[[(3-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-methylphenyl]-2-furancarboxamide IUPAC Name: N-[3-[(3-butoxybenzoyl)carbamothioylamino]-4-methylphenyl]furan-2-carboxamide Traditional Name: N-[3-[(3-butoxybenzoyl)thiocarbamoylamino]-4-methyl-phenyl]-2-furamide Formula: C24H25N3O4S MolecularWeight: 451.538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)NC(=O)C3=CC=CO3)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)NC(=O)C3=CC=CO3)C

InChI

InChI=1S/C24H25N3O4S/c1-3-4-12-30-19-8-5-7-17(14-19)22(28)27-24(32)26-20-15-18(11-10-16(20)2)25-23(29)21-9-6-13-31-21/h5-11,13-15H,3-4,12H2,1-2H3,(H,25,29)(H2,26,27,28,32)