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

Systemtic Name: N-(furan-2-ylmethyl)-4-[2-(2-methylphenyl)ethanoylcarbamothioylamino]benzamide Openeye Name: N-(2-furylmethyl)-4-[[2-(o-tolyl)acetyl]carbamothioylamino]benzamide CAS Name: N-(2-furanylmethyl)-4-[[[[2-(2-methylphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-4-[[2-(2-methylphenyl)acetyl]carbamothioylamino]benzamide Traditional Name: N-(2-furfuryl)-4-[[2-(o-tolyl)acetyl]thiocarbamoylamino]benzamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C22H21N3O3S/c1-15-5-2-3-6-17(15)13-20(26)25-22(29)24-18-10-8-16(9-11-18)21(27)23-14-19-7-4-12-28-19/h2-12H,13-14H2,1H3,(H,23,27)(H2,24,25,26,29)