propyl N'-[(2-chlorophenyl)methyl]carbamimidothioate

Systemtic Name: propyl N'-[(2-chlorophenyl)methyl]carbamimidothioate Openeye Name: 3-[(2-chlorophenyl)methyl]-2-propyl-isothiourea CAS Name: N'-[(2-chlorophenyl)methyl]carbamimidothioic acid propyl ester IUPAC Name: propyl N'-[(2-chlorophenyl)methyl]carbamimidothioate Traditional Name: 3-(2-chlorobenzyl)-2-propyl-isothiourea Formula: C11H15ClN2S MolecularWeight: 242.7682

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC(=NCC1=CC=CC=C1Cl)N

Isomeric SMILES

CCCSC(=NCC1=CC=CC=C1Cl)N

InChI

InChI=1S/C11H15ClN2S/c1-2-7-15-11(13)14-8-9-5-3-4-6-10(9)12/h3-6H,2,7-8H2,1H3,(H2,13,14)