2-[2-[(3-chlorophenyl)carbamothioylamino]ethanoylamino]-4-methyl-pentanamide

Systemtic Name: 2-[2-[(3-chlorophenyl)carbamothioylamino]ethanoylamino]-4-methyl-pentanamide Openeye Name: 2-[[2-[(3-chlorophenyl)carbamothioylamino]acetyl]amino]-4-methyl-pentanamide CAS Name: 2-[[2-[[(3-chloroanilino)-sulfanylidenemethyl]amino]-1-oxoethyl]amino]-4-methylpentanamide IUPAC Name: 2-[[2-[(3-chlorophenyl)carbamothioylamino]acetyl]amino]-4-methylpentanamide Traditional Name: 2-[[2-[(3-chlorophenyl)thiocarbamoylamino]acetyl]amino]-4-methyl-valeramide Formula: C15H21ClN4O2S MolecularWeight: 356.87084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NC(=O)CNC(=S)NC1=CC(=CC=C1)Cl

Isomeric SMILES

CC(C)CC(C(=O)N)NC(=O)CNC(=S)NC1=CC(=CC=C1)Cl

InChI

InChI=1S/C15H21ClN4O2S/c1-9(2)6-12(14(17)22)20-13(21)8-18-15(23)19-11-5-3-4-10(16)7-11/h3-5,7,9,12H,6,8H2,1-2H3,(H2,17,22)(H,20,21)(H2,18,19,23)