3-piperidin-1-ylpropyl N'-[(4-chlorophenyl)methyl]carbamimidothioate

Systemtic Name: 3-piperidin-1-ylpropyl N'-[(4-chlorophenyl)methyl]carbamimidothioate Openeye Name: 3-[(4-chlorophenyl)methyl]-2-[3-(1-piperidyl)propyl]isothiourea CAS Name: N'-[(4-chlorophenyl)methyl]carbamimidothioic acid 3-(1-piperidinyl)propyl ester IUPAC Name: 3-piperidin-1-ylpropyl N'-[(4-chlorophenyl)methyl]carbamimidothioate Traditional Name: 3-(4-chlorobenzyl)-2-(3-piperidinopropyl)isothiourea Formula: C16H24ClN3S MolecularWeight: 325.89986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCSC(=NCC2=CC=C(C=C2)Cl)N

Isomeric SMILES

C1CCN(CC1)CCCSC(=NCC2=CC=C(C=C2)Cl)N

InChI

InChI=1S/C16H24ClN3S/c17-15-7-5-14(6-8-15)13-19-16(18)21-12-4-11-20-9-2-1-3-10-20/h5-8H,1-4,9-13H2,(H2,18,19)