(3,4-dichlorophenyl)methyl N'-butylcarbamimidothioate

Systemtic Name: (3,4-dichlorophenyl)methyl N'-butylcarbamimidothioate Openeye Name: 3-butyl-2-[(3,4-dichlorophenyl)methyl]isothiourea CAS Name: N'-butylcarbamimidothioic acid (3,4-dichlorophenyl)methyl ester IUPAC Name: (3,4-dichlorophenyl)methyl N'-butylcarbamimidothioate Traditional Name: 3-butyl-2-(3,4-dichlorobenzyl)isothiourea Formula: C12H16Cl2N2S MolecularWeight: 291.23984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C(N)SCC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CCCCN=C(N)SCC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C12H16Cl2N2S/c1-2-3-6-16-12(15)17-8-9-4-5-10(13)11(14)7-9/h4-5,7H,2-3,6,8H2,1H3,(H2,15,16)