3-[2-[(2-butylsulfanyl-2-methyl-propyl)amino]ethylamino]-2-methyl-4-(4-methylpiperidin-1-yl)butane-2-thiol

Systemtic Name: 3-[2-[(2-butylsulfanyl-2-methyl-propyl)amino]ethylamino]-2-methyl-4-(4-methylpiperidin-1-yl)butane-2-thiol Openeye Name: 3-[2-[(2-butylsulfanyl-2-methyl-propyl)amino]ethylamino]-2-methyl-4-(4-methyl-1-piperidyl)butane-2-thiol CAS Name: 3-[2-[[2-(butylthio)-2-methylpropyl]amino]ethylamino]-2-methyl-4-(4-methyl-1-piperidinyl)-2-butanethiol IUPAC Name: 3-[2-[(2-butylsulfanyl-2-methylpropyl)amino]ethylamino]-2-methyl-4-(4-methylpiperidin-1-yl)butane-2-thiol Traditional Name: 3-[2-[[2-(butylthio)-2-methyl-propyl]amino]ethylamino]-2-methyl-4-(4-methylpiperidino)butane-2-thiol Formula: C21H45N3S2 MolecularWeight: 403.7321

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(C)(C)CNCCNC(CN1CCC(CC1)C)C(C)(C)S

Isomeric SMILES

CCCCSC(C)(C)CNCCNC(CN1CCC(CC1)C)C(C)(C)S

InChI

InChI=1S/C21H45N3S2/c1-7-8-15-26-20(3,4)17-22-11-12-23-19(21(5,6)25)16-24-13-9-18(2)10-14-24/h18-19,22-23,25H,7-17H2,1-6H3