4,4-bis(aminomethyl)-2-hexyl-thiolan-3-one

Systemtic Name: 4,4-bis(aminomethyl)-2-hexyl-thiolan-3-one Openeye Name: 4,4-bis(aminomethyl)-2-hexyl-tetrahydrothiophen-3-one CAS Name: 4,4-bis(aminomethyl)-2-hexyl-3-thiolanone IUPAC Name: 4,4-bis(aminomethyl)-2-hexylthiolan-3-one Traditional Name: 4,4-bis(aminomethyl)-2-hexyl-tetrahydrothiophen-3-one Formula: C12H24N2OS MolecularWeight: 244.39676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(=O)C(CS1)(CN)CN

Isomeric SMILES

CCCCCCC1C(=O)C(CS1)(CN)CN

InChI

InChI=1S/C12H24N2OS/c1-2-3-4-5-6-10-11(15)12(7-13,8-14)9-16-10/h10H,2-9,13-14H2,1H3