3-[2-azanylethyl-(2-methyl-2-sulfanyl-propyl)amino]-2-methyl-4-(pentylamino)butane-2-thiol

Systemtic Name: 3-[2-azanylethyl-(2-methyl-2-sulfanyl-propyl)amino]-2-methyl-4-(pentylamino)butane-2-thiol Openeye Name: 3-[2-aminoethyl-(2-methyl-2-sulfanyl-propyl)amino]-2-methyl-4-(pentylamino)butane-2-thiol CAS Name: 3-[2-aminoethyl-(2-mercapto-2-methylpropyl)amino]-2-methyl-4-(pentylamino)-2-butanethiol IUPAC Name: 3-[2-aminoethyl-(2-methyl-2-sulfanylpropyl)amino]-2-methyl-4-(pentylamino)butane-2-thiol Traditional Name: 3-[2-aminoethyl-(2-mercapto-2-methyl-propyl)amino]-4-(amylamino)-2-methyl-butane-2-thiol Formula: C16H37N3S2 MolecularWeight: 335.61508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC(C(C)(C)S)N(CCN)CC(C)(C)S

Isomeric SMILES

CCCCCNCC(C(C)(C)S)N(CCN)CC(C)(C)S

InChI

InChI=1S/C16H37N3S2/c1-6-7-8-10-18-12-14(16(4,5)21)19(11-9-17)13-15(2,3)20/h14,18,20-21H,6-13,17H2,1-5H3