N-(furan-2-ylmethyl)-3-[(4-hexoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(furan-2-ylmethyl)-3-[(4-hexoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(2-furylmethyl)-3-[(4-hexoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(2-furanylmethyl)-3-[[[[(4-hexoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-3-[(4-hexoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-(2-furfuryl)-3-[(4-hexoxybenzoyl)thiocarbamoylamino]benzamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CO3

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C26H29N3O4S/c1-2-3-4-5-15-32-22-13-11-19(12-14-22)25(31)29-26(34)28-21-9-6-8-20(17-21)24(30)27-18-23-10-7-16-33-23/h6-14,16-17H,2-5,15,18H2,1H3,(H,27,30)(H2,28,29,31,34)