N-(2-naphthalen-1-ylethyl)-N-[[(2R,3R)-3-sulfanylpyrrolidin-2-yl]methyl]-1,3-thiazole-5-carboxamide

Systemtic Name: N-(2-naphthalen-1-ylethyl)-N-[[(2R,3R)-3-sulfanylpyrrolidin-2-yl]methyl]-1,3-thiazole-5-carboxamide Openeye Name: N-[2-(1-naphthyl)ethyl]-N-[[(2R,3R)-3-sulfanylpyrrolidin-2-yl]methyl]thiazole-5-carboxamide CAS Name: N-[[(2R,3R)-3-mercapto-2-pyrrolidinyl]methyl]-N-[2-(1-naphthalenyl)ethyl]-5-thiazolecarboxamide IUPAC Name: N-(2-naphthalen-1-ylethyl)-N-[[(2R,3R)-3-sulfanylpyrrolidin-2-yl]methyl]-1,3-thiazole-5-carboxamide Traditional Name: N-[[(2R,3R)-3-mercaptopyrrolidin-2-yl]methyl]-N-[2-(1-naphthyl)ethyl]thiazole-5-carboxamide Formula: C21H23N3OS2 MolecularWeight: 397.55682

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C1S)CN(CCC2=CC=CC3=CC=CC=C32)C(=O)C4=CN=CS4

Isomeric SMILES

C1CN[C@@H]([C@@H]1S)CN(CCC2=CC=CC3=CC=CC=C32)C(=O)C4=CN=CS4

InChI

InChI=1S/C21H23N3OS2/c25-21(20-12-22-14-27-20)24(13-18-19(26)8-10-23-18)11-9-16-6-3-5-15-4-1-2-7-17(15)16/h1-7,12,14,18-19,23,26H,8-11,13H2/t18-,19-/m1/s1