N-butan-2-yl-3-(3-methylbutanoylcarbamothioylamino)benzamide

Systemtic Name: N-butan-2-yl-3-(3-methylbutanoylcarbamothioylamino)benzamide Openeye Name: 3-(3-methylbutanoylcarbamothioylamino)-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-3-[[[(3-methyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butan-2-yl-3-(3-methylbutanoylcarbamothioylamino)benzamide Traditional Name: 3-(isovalerylthiocarbamoylamino)-N-sec-butyl-benzamide Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)CC(C)C

Isomeric SMILES

CCC(C)NC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)CC(C)C

InChI

InChI=1S/C17H25N3O2S/c1-5-12(4)18-16(22)13-7-6-8-14(10-13)19-17(23)20-15(21)9-11(2)3/h6-8,10-12H,5,9H2,1-4H3,(H,18,22)(H2,19,20,21,23)