2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]butanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]butanamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]butanamide CAS Name: 2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-N-[[2-(1-pyrazolyl)-3-pyridinyl]methyl]butanamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]butanamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]butyramide Formula: C23H25N5OS MolecularWeight: 419.5425

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC1=NC2=CC=CC=C2S1)C(=O)NCC3=C(N=CC=C3)N4C=CC=N4

Isomeric SMILES

CCC(CC)(CC1=NC2=CC=CC=C2S1)C(=O)NCC3=C(N=CC=C3)N4C=CC=N4

InChI

InChI=1S/C23H25N5OS/c1-3-23(4-2,15-20-27-18-10-5-6-11-19(18)30-20)22(29)25-16-17-9-7-12-24-21(17)28-14-8-13-26-28/h5-14H,3-4,15-16H2,1-2H3,(H,25,29)