4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-N-butyl-4-oxidanylidene-butanamide

Systemtic Name: 4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-N-butyl-4-oxidanylidene-butanamide Openeye Name: 4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-N-butyl-4-oxo-butanamide CAS Name: 4-[(2S)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-N-butyl-4-oxobutanamide IUPAC Name: 4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-N-butyl-4-oxobutanamide Traditional Name: 4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidino]-N-butyl-4-keto-butyramide Formula: C19H25N3O2S MolecularWeight: 359.4857

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CCC(=O)N1CCCC1C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCCNC(=O)CCC(=O)N1CCC[C@H]1C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H25N3O2S/c1-2-3-12-20-17(23)10-11-18(24)22-13-6-8-15(22)19-21-14-7-4-5-9-16(14)25-19/h4-5,7,9,15H,2-3,6,8,10-13H2,1H3,(H,20,23)/t15-/m0/s1