N-(furan-2-ylmethyl)-3-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]benzamide

Systemtic Name: N-(furan-2-ylmethyl)-3-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]benzamide Openeye Name: N-(2-furylmethyl)-3-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]benzamide CAS Name: N-(2-furanylmethyl)-3-[[[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-3-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]benzamide Traditional Name: N-(2-furfuryl)-3-[[2-(4-methoxyphenyl)acetyl]thiocarbamoylamino]benzamide Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CO3

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C22H21N3O4S/c1-28-18-9-7-15(8-10-18)12-20(26)25-22(30)24-17-5-2-4-16(13-17)21(27)23-14-19-6-3-11-29-19/h2-11,13H,12,14H2,1H3,(H,23,27)(H2,24,25,26,30)