2-[2-[(2-iodanylphenyl)carbamothioylamino]ethanoylamino]-4-methyl-pentanamide

Systemtic Name: 2-[2-[(2-iodanylphenyl)carbamothioylamino]ethanoylamino]-4-methyl-pentanamide Openeye Name: 2-[[2-[(2-iodophenyl)carbamothioylamino]acetyl]amino]-4-methyl-pentanamide CAS Name: 2-[[2-[[(2-iodoanilino)-sulfanylidenemethyl]amino]-1-oxoethyl]amino]-4-methylpentanamide IUPAC Name: 2-[[2-[(2-iodophenyl)carbamothioylamino]acetyl]amino]-4-methylpentanamide Traditional Name: 2-[[2-[(2-iodophenyl)thiocarbamoylamino]acetyl]amino]-4-methyl-valeramide Formula: C15H21IN4O2S MolecularWeight: 448.32231

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NC(=O)CNC(=S)NC1=CC=CC=C1I

Isomeric SMILES

CC(C)CC(C(=O)N)NC(=O)CNC(=S)NC1=CC=CC=C1I

InChI

InChI=1S/C15H21IN4O2S/c1-9(2)7-12(14(17)22)19-13(21)8-18-15(23)20-11-6-4-3-5-10(11)16/h3-6,9,12H,7-8H2,1-2H3,(H2,17,22)(H,19,21)(H2,18,20,23)