(2S)-1-methoxy-N-[[4-(2-pyrrolidin-1-ylsulfonylphenyl)phenyl]methyl]propan-2-amine

Systemtic Name: (2S)-1-methoxy-N-[[4-(2-pyrrolidin-1-ylsulfonylphenyl)phenyl]methyl]propan-2-amine Openeye Name: (2S)-1-methoxy-N-[[4-(2-pyrrolidin-1-ylsulfonylphenyl)phenyl]methyl]propan-2-amine CAS Name: (2S)-1-methoxy-N-[[4-[2-(1-pyrrolidinylsulfonyl)phenyl]phenyl]methyl]-2-propanamine IUPAC Name: (2S)-1-methoxy-N-[[4-(2-pyrrolidin-1-ylsulfonylphenyl)phenyl]methyl]propan-2-amine Traditional Name: [(1S)-2-methoxy-1-methyl-ethyl]-[4-(2-pyrrolidinosulfonylphenyl)benzyl]amine Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NCC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)N3CCCC3

Isomeric SMILES

C[C@@H](COC)NCC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H28N2O3S/c1-17(16-26-2)22-15-18-9-11-19(12-10-18)20-7-3-4-8-21(20)27(24,25)23-13-5-6-14-23/h3-4,7-12,17,22H,5-6,13-16H2,1-2H3/t17-/m0/s1