[2-[bis(ethylsulfanyl)methyl]-4-methyl-pyrrolidin-1-yl]-(5-methoxy-4-methyl-2-nitro-phenyl)methanone

Systemtic Name: [2-[bis(ethylsulfanyl)methyl]-4-methyl-pyrrolidin-1-yl]-(5-methoxy-4-methyl-2-nitro-phenyl)methanone Openeye Name: [2-[bis(ethylsulfanyl)methyl]-4-methyl-pyrrolidin-1-yl]-(5-methoxy-4-methyl-2-nitro-phenyl)methanone CAS Name: [2-[bis(ethylthio)methyl]-4-methyl-1-pyrrolidinyl]-(5-methoxy-4-methyl-2-nitrophenyl)methanone IUPAC Name: [2-[bis(ethylsulfanyl)methyl]-4-methylpyrrolidin-1-yl]-(5-methoxy-4-methyl-2-nitrophenyl)methanone Traditional Name: [2-[bis(ethylthio)methyl]-4-methyl-pyrrolidino]-(5-methoxy-4-methyl-2-nitro-phenyl)methanone Formula: C19H28N2O4S2 MolecularWeight: 412.56662

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C1CC(CN1C(=O)C2=CC(=C(C=C2[N+](=O)[O-])C)OC)C)SCC

Isomeric SMILES

CCSC(C1CC(CN1C(=O)C2=CC(=C(C=C2[N+](=O)[O-])C)OC)C)SCC

InChI

InChI=1S/C19H28N2O4S2/c1-6-26-19(27-7-2)16-8-12(3)11-20(16)18(22)14-10-17(25-5)13(4)9-15(14)21(23)24/h9-10,12,16,19H,6-8,11H2,1-5H3