ethyl N'-[[4-(aminomethyl)phenyl]methyl]carbamimidothioate

Systemtic Name: ethyl N'-[[4-(aminomethyl)phenyl]methyl]carbamimidothioate Openeye Name: 3-[[4-(aminomethyl)phenyl]methyl]-2-ethyl-isothiourea CAS Name: N'-[[4-(aminomethyl)phenyl]methyl]carbamimidothioic acid ethyl ester IUPAC Name: ethyl N'-[[4-(aminomethyl)phenyl]methyl]carbamimidothioate Traditional Name: 3-[4-(aminomethyl)benzyl]-2-ethyl-isothiourea Formula: C11H17N3S MolecularWeight: 223.33778

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=NCC1=CC=C(C=C1)CN)N

Isomeric SMILES

CCSC(=NCC1=CC=C(C=C1)CN)N

InChI

InChI=1S/C11H17N3S/c1-2-15-11(13)14-8-10-5-3-9(7-12)4-6-10/h3-6H,2,7-8,12H2,1H3,(H2,13,14)