N-(1,3-benzothiazol-2-ylmethyl)-3-methylsulfanyl-3-pyrrolidin-2-yl-propanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-3-methylsulfanyl-3-pyrrolidin-2-yl-propanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-3-methylsulfanyl-3-pyrrolidin-2-yl-propanamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-3-(methylthio)-3-(2-pyrrolidinyl)propanamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-3-methylsulfanyl-3-pyrrolidin-2-ylpropanamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-3-(methylthio)-3-pyrrolidin-2-yl-propionamide Formula: C16H21N3OS2 MolecularWeight: 335.48744

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CC(=O)NCC1=NC2=CC=CC=C2S1)C3CCCN3

Isomeric SMILES

CSC(CC(=O)NCC1=NC2=CC=CC=C2S1)C3CCCN3

InChI

InChI=1S/C16H21N3OS2/c1-21-14(11-6-4-8-17-11)9-15(20)18-10-16-19-12-5-2-3-7-13(12)22-16/h2-3,5,7,11,14,17H,4,6,8-10H2,1H3,(H,18,20)