(2S,3S)-1-[(2R)-2-azanyl-3-sulfanyl-propyl]-3-ethyl-N-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S,3S)-1-[(2R)-2-azanyl-3-sulfanyl-propyl]-3-ethyl-N-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: (2S,3S)-1-[(2R)-2-amino-3-sulfanyl-propyl]-3-ethyl-N-(1-naphthylmethyl)pyrrolidine-2-carboxamide CAS Name: (2S,3S)-1-[(2R)-2-amino-3-mercaptopropyl]-3-ethyl-N-(1-naphthalenylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S,3S)-1-[(2R)-2-amino-3-sulfanylpropyl]-3-ethyl-N-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: (2S,3S)-1-[(2R)-2-amino-3-mercapto-propyl]-3-ethyl-N-(1-naphthylmethyl)pyrrolidine-2-carboxamide Formula: C21H29N3OS MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCN(C1C(=O)NCC2=CC=CC3=CC=CC=C32)CC(CS)N

Isomeric SMILES

CC[C@H]1CCN([C@@H]1C(=O)NCC2=CC=CC3=CC=CC=C32)C[C@H](CS)N

InChI

InChI=1S/C21H29N3OS/c1-2-15-10-11-24(13-18(22)14-26)20(15)21(25)23-12-17-8-5-7-16-6-3-4-9-19(16)17/h3-9,15,18,20,26H,2,10-14,22H2,1H3,(H,23,25)/t15-,18+,20-/m0/s1