(2-chlorophenyl)methyl N-cyano-N'-prop-2-enyl-carbamimidothioate

Systemtic Name: (2-chlorophenyl)methyl N-cyano-N'-prop-2-enyl-carbamimidothioate Openeye Name: 3-allyl-2-[(2-chlorophenyl)methyl]-1-cyano-isothiourea CAS Name: N-cyano-N'-prop-2-enylcarbamimidothioic acid (2-chlorophenyl)methyl ester IUPAC Name: (2-chlorophenyl)methyl N-cyano-N'-prop-2-enylcarbamimidothioate Traditional Name: 3-allyl-2-(2-chlorobenzyl)-1-cyano-isothiourea Formula: C12H12ClN3S MolecularWeight: 265.76178

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN=C(NC#N)SCC1=CC=CC=C1Cl

Isomeric SMILES

C=CCN=C(NC#N)SCC1=CC=CC=C1Cl

InChI

InChI=1S/C12H12ClN3S/c1-2-7-15-12(16-9-14)17-8-10-5-3-4-6-11(10)13/h2-6H,1,7-8H2,(H,15,16)