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

Systemtic Name: methyl N'-[3-(1-azanylcyclobutyl)phenyl]carbamimidothioate Openeye Name: 3-[3-(1-aminocyclobutyl)phenyl]-2-methyl-isothiourea CAS Name: N'-[3-(1-aminocyclobutyl)phenyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[3-(1-aminocyclobutyl)phenyl]carbamimidothioate Traditional Name: 3-[3-(1-aminocyclobutyl)phenyl]-2-methyl-isothiourea Formula: C12H17N3S MolecularWeight: 235.34848

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CC=CC(=C1)C2(CCC2)N)N

Isomeric SMILES

CSC(=NC1=CC=CC(=C1)C2(CCC2)N)N

InChI

InChI=1S/C12H17N3S/c1-16-11(13)15-10-5-2-4-9(8-10)12(14)6-3-7-12/h2,4-5,8H,3,6-7,14H2,1H3,(H2,13,15)