3-[[3-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: 3-[[3-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 3-[(3-isopentyloxybenzoyl)carbamothioylamino]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 3-[[[[[3-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 3-[[3-(3-methylbutoxy)benzoyl]carbamothioylamino]-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 3-[(3-isoamoxybenzoyl)thiocarbamoylamino]-N-(tetrahydrofurfuryl)benzamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3CCCO3

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3CCCO3

InChI

InChI=1S/C25H31N3O4S/c1-17(2)11-13-32-21-9-4-7-19(15-21)24(30)28-25(33)27-20-8-3-6-18(14-20)23(29)26-16-22-10-5-12-31-22/h3-4,6-9,14-15,17,22H,5,10-13,16H2,1-2H3,(H,26,29)(H2,27,28,30,33)