(4-cyanophenyl)methyl N'-cyclopentylcarbamimidothioate

Systemtic Name: (4-cyanophenyl)methyl N'-cyclopentylcarbamimidothioate Openeye Name: 2-[(4-cyanophenyl)methyl]-3-cyclopentyl-isothiourea CAS Name: N'-cyclopentylcarbamimidothioic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl N'-cyclopentylcarbamimidothioate Traditional Name: 2-(4-cyanobenzyl)-3-cyclopentyl-isothiourea Formula: C14H17N3S MolecularWeight: 259.36988

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N=C(N)SCC2=CC=C(C=C2)C#N

Isomeric SMILES

C1CCC(C1)N=C(N)SCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H17N3S/c15-9-11-5-7-12(8-6-11)10-18-14(16)17-13-3-1-2-4-13/h5-8,13H,1-4,10H2,(H2,16,17)