2-ethyl-N-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-benzothiazol-6-yl]butanamide

Systemtic Name: 2-ethyl-N-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-benzothiazol-6-yl]butanamide Openeye Name: 2-ethyl-N-[2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-benzothiazol-6-yl]butanamide CAS Name: 2-ethyl-N-[2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-1,3-benzothiazol-6-yl]butanamide IUPAC Name: 2-ethyl-N-[2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-1,3-benzothiazol-6-yl]butanamide Traditional Name: 2-ethyl-N-[2-[(2-keto-2-pyrrolidino-ethyl)thio]-1,3-benzothiazol-6-yl]butyramide Formula: C19H25N3O2S2 MolecularWeight: 391.5507

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)N3CCCC3

Isomeric SMILES

CCC(CC)C(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)N3CCCC3

InChI

InChI=1S/C19H25N3O2S2/c1-3-13(4-2)18(24)20-14-7-8-15-16(11-14)26-19(21-15)25-12-17(23)22-9-5-6-10-22/h7-8,11,13H,3-6,9-10,12H2,1-2H3,(H,20,24)