N-(2-oxidanylsulfonothioyloxyethyl)-N'-phenyl-propane-1,3-diamine

Systemtic Name: N-(2-oxidanylsulfonothioyloxyethyl)-N'-phenyl-propane-1,3-diamine Openeye Name: N-(2-hydroxysulfonothioyloxyethyl)-N'-phenyl-propane-1,3-diamine CAS Name: N-(2-hydroxysulfonothioyloxyethyl)-N'-phenylpropane-1,3-diamine IUPAC Name: N-(2-hydroxysulfonothioyloxyethyl)-N'-phenylpropane-1,3-diamine Traditional Name: 3-anilinopropyl(2-hydroxysulfonothioyloxyethyl)amine Formula: C11H18N2O3S2 MolecularWeight: 290.40222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NCCCNCCOS(=O)(=S)O

Isomeric SMILES

C1=CC=C(C=C1)NCCCNCCOS(=O)(=S)O

InChI

InChI=1S/C11H18N2O3S2/c14-18(15,17)16-10-9-12-7-4-8-13-11-5-2-1-3-6-11/h1-3,5-6,12-13H,4,7-10H2,(H,14,15,17)