N-butyl-4-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]benzamide

Systemtic Name: N-butyl-4-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: N-butyl-4-[(4-isopentyloxybenzoyl)carbamothioylamino]benzamide CAS Name: N-butyl-4-[[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butyl-4-[[4-(3-methylbutoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-butyl-4-[(4-isoamoxybenzoyl)thiocarbamoylamino]benzamide Formula: C24H31N3O3S MolecularWeight: 441.58624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCC(C)C

Isomeric SMILES

CCCCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCC(C)C

InChI

InChI=1S/C24H31N3O3S/c1-4-5-15-25-22(28)18-6-10-20(11-7-18)26-24(31)27-23(29)19-8-12-21(13-9-19)30-16-14-17(2)3/h6-13,17H,4-5,14-16H2,1-3H3,(H,25,28)(H2,26,27,29,31)