N-tert-butyl-2-[5-ethyl-6-methyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-propanamide

Systemtic Name: N-tert-butyl-2-[5-ethyl-6-methyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-propanamide Openeye Name: N-tert-butyl-2-[5-ethyl-6-methyl-4-oxo-3-(tetrahydrofuran-2-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-propanamide CAS Name: N-tert-butyl-2-[[5-ethyl-6-methyl-4-oxo-3-(2-oxolanylmethyl)-2-thieno[2,3-d]pyrimidinyl]thio]propanamide IUPAC Name: N-tert-butyl-2-[5-ethyl-6-methyl-4-oxo-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanylpropanamide Traditional Name: N-tert-butyl-2-[[5-ethyl-4-keto-6-methyl-3-(tetrahydrofurfuryl)thieno[2,3-d]pyrimidin-2-yl]thio]propionamide Formula: C21H31N3O3S2 MolecularWeight: 437.61914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SC(C)C(=O)NC(C)(C)C)CC3CCCO3)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SC(C)C(=O)NC(C)(C)C)CC3CCCO3)C

InChI

InChI=1S/C21H31N3O3S2/c1-7-15-12(2)28-18-16(15)19(26)24(11-14-9-8-10-27-14)20(22-18)29-13(3)17(25)23-21(4,5)6/h13-14H,7-11H2,1-6H3,(H,23,25)