(4-azanyl-1-ethyl-5-methyl-pyrazol-3-yl)-[(2S)-2-[bis(ethylsulfanyl)methyl]pyrrolidin-1-yl]methanone

Systemtic Name: (4-azanyl-1-ethyl-5-methyl-pyrazol-3-yl)-[(2S)-2-[bis(ethylsulfanyl)methyl]pyrrolidin-1-yl]methanone Openeye Name: (4-amino-1-ethyl-5-methyl-pyrazol-3-yl)-[(2S)-2-[bis(ethylsulfanyl)methyl]pyrrolidin-1-yl]methanone CAS Name: (4-amino-1-ethyl-5-methyl-3-pyrazolyl)-[(2S)-2-[bis(ethylthio)methyl]-1-pyrrolidinyl]methanone IUPAC Name: (4-amino-1-ethyl-5-methylpyrazol-3-yl)-[(2S)-2-[bis(ethylsulfanyl)methyl]pyrrolidin-1-yl]methanone Traditional Name: (4-amino-1-ethyl-5-methyl-pyrazol-3-yl)-[(2S)-2-[bis(ethylthio)methyl]pyrrolidino]methanone Formula: C16H28N4OS2 MolecularWeight: 356.54972

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C(=O)N2CCCC2C(SCC)SCC)N)C

Isomeric SMILES

CCN1C(=C(C(=N1)C(=O)N2CCC[C@H]2C(SCC)SCC)N)C

InChI

InChI=1S/C16H28N4OS2/c1-5-20-11(4)13(17)14(18-20)15(21)19-10-8-9-12(19)16(22-6-2)23-7-3/h12,16H,5-10,17H2,1-4H3/t12-/m0/s1