N-[2-(tert-butylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-cyclohexyl-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-cyclohexyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-1-(4-pyridyl)ethyl]-N-cyclohexyl-thiadiazole-4-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxo-1-pyridin-4-ylethyl]-N-cyclohexyl-4-thiadiazolecarboxamide IUPAC Name: N-[2-(tert-butylamino)-2-oxo-1-pyridin-4-ylethyl]-N-cyclohexylthiadiazole-4-carboxamide Traditional Name: N-[2-(tert-butylamino)-2-keto-1-(4-pyridyl)ethyl]-N-cyclohexyl-thiadiazole-4-carboxamide Formula: C20H27N5O2S MolecularWeight: 401.52568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CC=NC=C1)N(C2CCCCC2)C(=O)C3=CSN=N3

Isomeric SMILES

CC(C)(C)NC(=O)C(C1=CC=NC=C1)N(C2CCCCC2)C(=O)C3=CSN=N3

InChI

InChI=1S/C20H27N5O2S/c1-20(2,3)22-18(26)17(14-9-11-21-12-10-14)25(15-7-5-4-6-8-15)19(27)16-13-28-24-23-16/h9-13,15,17H,4-8H2,1-3H3,(H,22,26)