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

Systemtic Name: N-(furan-2-ylmethyl)-4-[(4-hexoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(2-furylmethyl)-4-[(4-hexoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(2-furanylmethyl)-4-[[[[(4-hexoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-4-[(4-hexoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-(2-furfuryl)-4-[(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=C(C=C2)C(=O)NCC3=CC=CO3

Isomeric SMILES

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

InChI

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