N-(furan-2-ylmethyl)-2-[(2-hexoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(furan-2-ylmethyl)-2-[(2-hexoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(2-furylmethyl)-2-[(2-hexoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(2-furanylmethyl)-2-[[[[(2-hexoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-2-[(2-hexoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-(2-furfuryl)-2-[(2-hexoxybenzoyl)thiocarbamoylamino]benzamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC3=CC=CO3

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC3=CC=CO3

InChI

InChI=1S/C26H29N3O4S/c1-2-3-4-9-16-33-23-15-8-6-13-21(23)25(31)29-26(34)28-22-14-7-5-12-20(22)24(30)27-18-19-11-10-17-32-19/h5-8,10-15,17H,2-4,9,16,18H2,1H3,(H,27,30)(H2,28,29,31,34)