N-[3,3-bis(methylsulfanyl)-2-pyrrolidin-1-yl-cyclohexyl]-4-bromanyl-N-methyl-benzamide

Systemtic Name: N-[3,3-bis(methylsulfanyl)-2-pyrrolidin-1-yl-cyclohexyl]-4-bromanyl-N-methyl-benzamide Openeye Name: N-[3,3-bis(methylsulfanyl)-2-pyrrolidin-1-yl-cyclohexyl]-4-bromo-N-methyl-benzamide CAS Name: N-[3,3-bis(methylthio)-2-(1-pyrrolidinyl)cyclohexyl]-4-bromo-N-methylbenzamide IUPAC Name: N-[3,3-bis(methylsulfanyl)-2-pyrrolidin-1-ylcyclohexyl]-4-bromo-N-methylbenzamide Traditional Name: N-[3,3-bis(methylthio)-2-pyrrolidino-cyclohexyl]-4-bromo-N-methyl-benzamide Formula: C20H29BrN2OS2 MolecularWeight: 457.49106

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCC(C1N2CCCC2)(SC)SC)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(C1CCCC(C1N2CCCC2)(SC)SC)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H29BrN2OS2/c1-22(19(24)15-8-10-16(21)11-9-15)17-7-6-12-20(25-2,26-3)18(17)23-13-4-5-14-23/h8-11,17-18H,4-7,12-14H2,1-3H3