3-azanyl-5-methyl-1-(3-methylbutylamino)hexane-2-thiol

Systemtic Name: 3-azanyl-5-methyl-1-(3-methylbutylamino)hexane-2-thiol Openeye Name: 3-amino-1-(isopentylamino)-5-methyl-hexane-2-thiol CAS Name: 3-amino-5-methyl-1-(3-methylbutylamino)-2-hexanethiol IUPAC Name: 3-amino-5-methyl-1-(3-methylbutylamino)hexane-2-thiol Traditional Name: 3-amino-1-(isoamylamino)-5-methyl-hexane-2-thiol Formula: C12H28N2S MolecularWeight: 232.42912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNCC(C(CC(C)C)N)S

Isomeric SMILES

CC(C)CCNCC(C(CC(C)C)N)S

InChI

InChI=1S/C12H28N2S/c1-9(2)5-6-14-8-12(15)11(13)7-10(3)4/h9-12,14-15H,5-8,13H2,1-4H3