N-(furan-2-ylmethyl)-4-(2-phenylethanoylcarbamothioylamino)benzamide

Systemtic Name: N-(furan-2-ylmethyl)-4-(2-phenylethanoylcarbamothioylamino)benzamide Openeye Name: N-(2-furylmethyl)-4-[(2-phenylacetyl)carbamothioylamino]benzamide CAS Name: N-(2-furanylmethyl)-4-[[[(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-4-[(2-phenylacetyl)carbamothioylamino]benzamide Traditional Name: N-(2-furfuryl)-4-[(2-phenylacetyl)thiocarbamoylamino]benzamide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N3O3S/c25-19(13-15-5-2-1-3-6-15)24-21(28)23-17-10-8-16(9-11-17)20(26)22-14-18-7-4-12-27-18/h1-12H,13-14H2,(H,22,26)(H2,23,24,25,28)