3,3-bis(2-methylpropylsulfanyl)-2-pyrrolidin-1-ylcarbonyl-prop-2-enenitrile

Systemtic Name: 3,3-bis(2-methylpropylsulfanyl)-2-pyrrolidin-1-ylcarbonyl-prop-2-enenitrile Openeye Name: 3,3-bis(isobutylsulfanyl)-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile CAS Name: 3,3-bis(2-methylpropylthio)-2-[oxo(1-pyrrolidinyl)methyl]-2-propenenitrile IUPAC Name: 3,3-bis(2-methylpropylsulfanyl)-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile Traditional Name: 3,3-bis(isobutylthio)-2-(pyrrolidine-1-carbonyl)acrylonitrile Formula: C16H26N2OS2 MolecularWeight: 326.52044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC(=C(C#N)C(=O)N1CCCC1)SCC(C)C

Isomeric SMILES

CC(C)CSC(=C(C#N)C(=O)N1CCCC1)SCC(C)C

InChI

InChI=1S/C16H26N2OS2/c1-12(2)10-20-16(21-11-13(3)4)14(9-17)15(19)18-7-5-6-8-18/h12-13H,5-8,10-11H2,1-4H3