N-(4-tert-butylphenyl)-2-(1-cyclopentyl-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-tert-butylphenyl)-2-(1-cyclopentyl-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-tert-butylphenyl)-2-(1-cyclopentyl-6-hydroxy-4-oxo-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(4-tert-butylphenyl)-2-[(1-cyclopentyl-6-hydroxy-4-oxo-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(4-tert-butylphenyl)-2-(1-cyclopentyl-6-hydroxy-4-oxopyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(4-tert-butylphenyl)-2-[(1-cyclopentyl-6-hydroxy-4-keto-pyrimidin-2-yl)thio]acetamide Formula: C21H27N3O3S MolecularWeight: 401.52238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C=C(N2C3CCCC3)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C=C(N2C3CCCC3)O

InChI

InChI=1S/C21H27N3O3S/c1-21(2,3)14-8-10-15(11-9-14)22-18(26)13-28-20-23-17(25)12-19(27)24(20)16-6-4-5-7-16/h8-12,16,27H,4-7,13H2,1-3H3,(H,22,26)