(2S,3S)-N-[(6-methoxy-2-phenyl-1,3-benzothiazol-7-yl)methyl]-2-phenyl-pyrrolidin-3-amine

Systemtic Name: (2S,3S)-N-[(6-methoxy-2-phenyl-1,3-benzothiazol-7-yl)methyl]-2-phenyl-pyrrolidin-3-amine Openeye Name: (2S,3S)-N-[(6-methoxy-2-phenyl-1,3-benzothiazol-7-yl)methyl]-2-phenyl-pyrrolidin-3-amine CAS Name: (2S,3S)-N-[(6-methoxy-2-phenyl-1,3-benzothiazol-7-yl)methyl]-2-phenyl-3-pyrrolidinamine IUPAC Name: (2S,3S)-N-[(6-methoxy-2-phenyl-1,3-benzothiazol-7-yl)methyl]-2-phenylpyrrolidin-3-amine Traditional Name: (6-methoxy-2-phenyl-1,3-benzothiazol-7-yl)methyl-[(2S,3S)-2-phenylpyrrolidin-3-yl]amine Formula: C25H25N3OS MolecularWeight: 415.5505

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)N=C(S2)C3=CC=CC=C3)CNC4CCNC4C5=CC=CC=C5

Isomeric SMILES

COC1=C(C2=C(C=C1)N=C(S2)C3=CC=CC=C3)CN[C@H]4CCN[C@H]4C5=CC=CC=C5

InChI

InChI=1S/C25H25N3OS/c1-29-22-13-12-21-24(30-25(28-21)18-10-6-3-7-11-18)19(22)16-27-20-14-15-26-23(20)17-8-4-2-5-9-17/h2-13,20,23,26-27H,14-16H2,1H3/t20-,23-/m0/s1