4-azanylbutyl N'-phenylcarbamimidothioate

Systemtic Name: 4-azanylbutyl N'-phenylcarbamimidothioate Openeye Name: 2-(4-aminobutyl)-3-phenyl-isothiourea CAS Name: N'-phenylcarbamimidothioic acid 4-aminobutyl ester IUPAC Name: 4-aminobutyl N'-phenylcarbamimidothioate Traditional Name: 2-(4-aminobutyl)-3-phenyl-isothiourea Formula: C11H17N3S MolecularWeight: 223.33778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=C(N)SCCCCN

Isomeric SMILES

C1=CC=C(C=C1)N=C(N)SCCCCN

InChI

InChI=1S/C11H17N3S/c12-8-4-5-9-15-11(13)14-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,12H2,(H2,13,14)