2-methoxy-5-methylsulfanyl-N-[[(2S)-1-phenethylpyrrolidin-2-yl]methyl]benzamide

Systemtic Name: 2-methoxy-5-methylsulfanyl-N-[[(2S)-1-phenethylpyrrolidin-2-yl]methyl]benzamide Openeye Name: 2-methoxy-5-methylsulfanyl-N-[[(2S)-1-phenethylpyrrolidin-2-yl]methyl]benzamide CAS Name: 2-methoxy-5-(methylthio)-N-[[(2S)-1-phenethyl-2-pyrrolidinyl]methyl]benzamide IUPAC Name: 2-methoxy-5-methylsulfanyl-N-[[(2S)-1-phenethylpyrrolidin-2-yl]methyl]benzamide Traditional Name: 2-methoxy-5-(methylthio)-N-[[(2S)-1-phenethylpyrrolidin-2-yl]methyl]benzamide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SC)C(=O)NCC2CCCN2CCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)SC)C(=O)NC[C@@H]2CCCN2CCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O2S/c1-26-21-11-10-19(27-2)15-20(21)22(25)23-16-18-9-6-13-24(18)14-12-17-7-4-3-5-8-17/h3-5,7-8,10-11,15,18H,6,9,12-14,16H2,1-2H3,(H,23,25)/t18-/m0/s1