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

Systemtic Name: N-(furan-2-ylmethyl)-2-[(4-hexoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(2-furylmethyl)-2-[(4-hexoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(2-furanylmethyl)-2-[[[[(4-hexoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-2-[(4-hexoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-(2-furfuryl)-2-[(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=C2C(=O)NCC3=CC=CO3

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC3=CC=CO3

InChI

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