3-(1,3-benzothiazol-2-yl)-3-cyano-N,N,N',N'-tetra(propan-2-yl)pentanediamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-3-cyano-N,N,N',N'-tetra(propan-2-yl)pentanediamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-3-cyano-N,N,N',N'-tetraisopropyl-pentanediamide CAS Name: 3-(1,3-benzothiazol-2-yl)-3-cyano-N,N,N',N'-tetra(propan-2-yl)pentanediamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-3-cyano-N,N,N',N'-tetra(propan-2-yl)pentanediamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-3-cyano-N,N,N',N'-tetraisopropyl-glutaramide Formula: C25H36N4O2S MolecularWeight: 456.64394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)CC(CC(=O)N(C(C)C)C(C)C)(C#N)C1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)N(C(C)C)C(=O)CC(CC(=O)N(C(C)C)C(C)C)(C#N)C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C25H36N4O2S/c1-16(2)28(17(3)4)22(30)13-25(15-26,14-23(31)29(18(5)6)19(7)8)24-27-20-11-9-10-12-21(20)32-24/h9-12,16-19H,13-14H2,1-8H3