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

Systemtic Name: N-methyl-3-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: 3-[(4-isopentyloxybenzoyl)carbamothioylamino]-N-methyl-benzamide CAS Name: N-methyl-3-[[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-methyl-3-[[4-(3-methylbutoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: 3-[(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(=C2)C(=O)NC

Isomeric SMILES

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

InChI

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