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

Systemtic Name: 3-(3-methylbutanoylcarbamothioylamino)-N-propan-2-yl-benzamide Openeye Name: N-isopropyl-3-(3-methylbutanoylcarbamothioylamino)benzamide CAS Name: 3-[[[(3-methyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]-N-propan-2-ylbenzamide IUPAC Name: 3-(3-methylbutanoylcarbamothioylamino)-N-propan-2-ylbenzamide Traditional Name: N-isopropyl-3-(isovalerylthiocarbamoylamino)benzamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)NC(C)C

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)NC(C)C

InChI

InChI=1S/C16H23N3O2S/c1-10(2)8-14(20)19-16(22)18-13-7-5-6-12(9-13)15(21)17-11(3)4/h5-7,9-11H,8H2,1-4H3,(H,17,21)(H2,18,19,20,22)