(2S)-N-[(3-chloranyl-1-benzothiophen-2-yl)methyl]-1-ethanoyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(3-chloranyl-1-benzothiophen-2-yl)methyl]-1-ethanoyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-1-acetyl-N-[(3-chlorobenzothiophen-2-yl)methyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-acetyl-N-[(3-chloro-1-benzothiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-acetyl-N-[(3-chloro-1-benzothiophen-2-yl)methyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-acetyl-N-[(3-chlorobenzothiophen-2-yl)methyl]pyrrolidine-2-carboxamide Formula: C16H17ClN2O2S MolecularWeight: 336.83638

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC1C(=O)NCC2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC(=O)N1CCC[C@H]1C(=O)NCC2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C16H17ClN2O2S/c1-10(20)19-8-4-6-12(19)16(21)18-9-14-15(17)11-5-2-3-7-13(11)22-14/h2-3,5,7,12H,4,6,8-9H2,1H3,(H,18,21)/t12-/m0/s1