N-(furan-2-ylmethyl)-3-(3-phenylpropanoylcarbamothioylamino)benzamide

Systemtic Name: N-(furan-2-ylmethyl)-3-(3-phenylpropanoylcarbamothioylamino)benzamide Openeye Name: N-(2-furylmethyl)-3-(3-phenylpropanoylcarbamothioylamino)benzamide CAS Name: N-(2-furanylmethyl)-3-[[[(1-oxo-3-phenylpropyl)amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-3-(3-phenylpropanoylcarbamothioylamino)benzamide Traditional Name: N-(2-furfuryl)-3-(hydrocinnamoylthiocarbamoylamino)benzamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O3S/c26-20(12-11-16-6-2-1-3-7-16)25-22(29)24-18-9-4-8-17(14-18)21(27)23-15-19-10-5-13-28-19/h1-10,13-14H,11-12,15H2,(H,23,27)(H2,24,25,26,29)