1-[(4-chlorophenyl)methyl]-3-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]thiourea

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]thiourea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]thiourea CAS Name: 1-[(4-chlorophenyl)methyl]-3-[[(4-iodo-1-methyl-3-pyrazolyl)-oxomethyl]amino]thiourea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-[(4-iodo-1-methylpyrazole-3-carbonyl)amino]thiourea Traditional Name: 1-(4-chlorobenzyl)-3-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]thiourea Formula: C13H13ClIN5OS MolecularWeight: 449.69769

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NNC(=S)NCC2=CC=C(C=C2)Cl)I

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NNC(=S)NCC2=CC=C(C=C2)Cl)I

InChI

InChI=1S/C13H13ClIN5OS/c1-20-7-10(15)11(19-20)12(21)17-18-13(22)16-6-8-2-4-9(14)5-3-8/h2-5,7H,6H2,1H3,(H,17,21)(H2,16,18,22)