ethyl N'-[3-(1-azanylpropyl)phenyl]carbamimidothioate

Systemtic Name: ethyl N'-[3-(1-azanylpropyl)phenyl]carbamimidothioate Openeye Name: 3-[3-(1-aminopropyl)phenyl]-2-ethyl-isothiourea CAS Name: N'-[3-(1-aminopropyl)phenyl]carbamimidothioic acid ethyl ester IUPAC Name: ethyl N'-[3-(1-aminopropyl)phenyl]carbamimidothioate Traditional Name: 3-[3-(1-aminopropyl)phenyl]-2-ethyl-isothiourea Formula: C12H19N3S MolecularWeight: 237.36436

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)N=C(N)SCC)N

Isomeric SMILES

CCC(C1=CC(=CC=C1)N=C(N)SCC)N

InChI

InChI=1S/C12H19N3S/c1-3-11(13)9-6-5-7-10(8-9)15-12(14)16-4-2/h5-8,11H,3-4,13H2,1-2H3,(H2,14,15)