methyl N'-[3-(1-azanylcyclopentyl)phenyl]carbamimidothioate

Systemtic Name: methyl N'-[3-(1-azanylcyclopentyl)phenyl]carbamimidothioate Openeye Name: 3-[3-(1-aminocyclopentyl)phenyl]-2-methyl-isothiourea CAS Name: N'-[3-(1-aminocyclopentyl)phenyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[3-(1-aminocyclopentyl)phenyl]carbamimidothioate Traditional Name: 3-[3-(1-aminocyclopentyl)phenyl]-2-methyl-isothiourea Formula: C13H19N3S MolecularWeight: 249.37506

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CC=CC(=C1)C2(CCCC2)N)N

Isomeric SMILES

CSC(=NC1=CC=CC(=C1)C2(CCCC2)N)N

InChI

InChI=1S/C13H19N3S/c1-17-12(14)16-11-6-4-5-10(9-11)13(15)7-2-3-8-13/h4-6,9H,2-3,7-8,15H2,1H3,(H2,14,16)