2,2-bis(chloranyl)-N-(3-imidazol-1-ylpropylcarbamothioyl)-1-methyl-cyclopropane-1-carboxamide

Systemtic Name: 2,2-bis(chloranyl)-N-(3-imidazol-1-ylpropylcarbamothioyl)-1-methyl-cyclopropane-1-carboxamide Openeye Name: 2,2-dichloro-N-(3-imidazol-1-ylpropylcarbamothioyl)-1-methyl-cyclopropanecarboxamide CAS Name: 2,2-dichloro-N-[[3-(1-imidazolyl)propylamino]-sulfanylidenemethyl]-1-methyl-1-cyclopropanecarboxamide IUPAC Name: 2,2-dichloro-N-(3-imidazol-1-ylpropylcarbamothioyl)-1-methylcyclopropane-1-carboxamide Traditional Name: 2,2-dichloro-N-(3-imidazol-1-ylpropylthiocarbamoyl)-1-methyl-cyclopropanecarboxamide Formula: C12H16Cl2N4OS MolecularWeight: 335.25264

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1(Cl)Cl)C(=O)NC(=S)NCCCN2C=CN=C2

Isomeric SMILES

CC1(CC1(Cl)Cl)C(=O)NC(=S)NCCCN2C=CN=C2

InChI

InChI=1S/C12H16Cl2N4OS/c1-11(7-12(11,13)14)9(19)17-10(20)16-3-2-5-18-6-4-15-8-18/h4,6,8H,2-3,5,7H2,1H3,(H2,16,17,19,20)