N-tert-butyl-4-[(4-hexoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-tert-butyl-4-[(4-hexoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-tert-butyl-4-[(4-hexoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-tert-butyl-4-[[[[(4-hexoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-tert-butyl-4-[(4-hexoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-tert-butyl-4-[(4-hexoxybenzoyl)thiocarbamoylamino]benzamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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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)NC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O3S/c1-5-6-7-8-17-31-21-15-11-18(12-16-21)22(29)27-24(32)26-20-13-9-19(10-14-20)23(30)28-25(2,3)4/h9-16H,5-8,17H2,1-4H3,(H,28,30)(H2,26,27,29,32)