1-[[2-[[(E)-but-2-enyl]sulfanyl-(2-methylpropyl)amino]phenyl]amino]-2-methyl-propane-2-thiol

Systemtic Name: 1-[[2-[[(E)-but-2-enyl]sulfanyl-(2-methylpropyl)amino]phenyl]amino]-2-methyl-propane-2-thiol Openeye Name: 1-[2-[[(E)-but-2-enyl]sulfanyl-isobutyl-amino]anilino]-2-methyl-propane-2-thiol CAS Name: (E)-N-[2-[(2-mercapto-2-methylpropyl)amino]phenyl]-N-(2-methylpropyl)-2-butene-1-sulfenamide IUPAC Name: 1-[2-[[(E)-but-2-enyl]sulfanyl-(2-methylpropyl)amino]anilino]-2-methylpropane-2-thiol Traditional Name: 1-[2-[[[(E)-but-2-enyl]thio]-isobutyl-amino]anilino]-2-methyl-propane-2-thiol Formula: C18H30N2S2 MolecularWeight: 338.5742

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCSN(CC(C)C)C1=CC=CC=C1NCC(C)(C)S

Isomeric SMILES

C/C=C/CSN(CC(C)C)C1=CC=CC=C1NCC(C)(C)S

InChI

InChI=1S/C18H30N2S2/c1-6-7-12-22-20(13-15(2)3)17-11-9-8-10-16(17)19-14-18(4,5)21/h6-11,15,19,21H,12-14H2,1-5H3/b7-6+