N-methyl-2-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]benzamide

Systemtic Name: N-methyl-2-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: 2-[(4-isopentyloxybenzoyl)carbamothioylamino]-N-methyl-benzamide CAS Name: N-methyl-2-[[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-methyl-2-[[4-(3-methylbutoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: 2-[(4-isoamoxybenzoyl)thiocarbamoylamino]-N-methyl-benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC

InChI

InChI=1S/C21H25N3O3S/c1-14(2)12-13-27-16-10-8-15(9-11-16)19(25)24-21(28)23-18-7-5-4-6-17(18)20(26)22-3/h4-11,14H,12-13H2,1-3H3,(H,22,26)(H2,23,24,25,28)