(3S)-N-(cyclohexylmethyl)-N-[(2-methylsulfanylphenyl)methyl]pyrrolidin-3-amine

Systemtic Name: (3S)-N-(cyclohexylmethyl)-N-[(2-methylsulfanylphenyl)methyl]pyrrolidin-3-amine Openeye Name: (3S)-N-(cyclohexylmethyl)-N-[(2-methylsulfanylphenyl)methyl]pyrrolidin-3-amine CAS Name: (3S)-N-(cyclohexylmethyl)-N-[[2-(methylthio)phenyl]methyl]-3-pyrrolidinamine IUPAC Name: (3S)-N-(cyclohexylmethyl)-N-[(2-methylsulfanylphenyl)methyl]pyrrolidin-3-amine Traditional Name: cyclohexylmethyl-[2-(methylthio)benzyl]-[(3S)-pyrrolidin-3-yl]amine Formula: C19H30N2S MolecularWeight: 318.5199

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1CN(CC2CCCCC2)C3CCNC3

Isomeric SMILES

CSC1=CC=CC=C1CN(CC2CCCCC2)[C@H]3CCNC3

InChI

InChI=1S/C19H30N2S/c1-22-19-10-6-5-9-17(19)15-21(18-11-12-20-13-18)14-16-7-3-2-4-8-16/h5-6,9-10,16,18,20H,2-4,7-8,11-15H2,1H3/t18-/m0/s1