prop-2-enyl N-[3-(6-aminocarbonyl-5-azanyl-1-tert-butyl-2-methylsulfanyl-7aH-thieno[2,3-d]pyrimidin-4-yl)phenyl]carbamate

Systemtic Name: prop-2-enyl N-[3-(6-aminocarbonyl-5-azanyl-1-tert-butyl-2-methylsulfanyl-7aH-thieno[2,3-d]pyrimidin-4-yl)phenyl]carbamate Openeye Name: allyl N-[3-(5-amino-1-tert-butyl-6-carbamoyl-2-methylsulfanyl-7aH-thieno[2,3-d]pyrimidin-4-yl)phenyl]carbamate CAS Name: N-[3-[5-amino-1-tert-butyl-6-carbamoyl-2-(methylthio)-7aH-thieno[2,3-d]pyrimidin-4-yl]phenyl]carbamic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N-[3-(5-amino-1-tert-butyl-6-carbamoyl-2-methylsulfanyl-7aH-thieno[2,3-d]pyrimidin-4-yl)phenyl]carbamate Traditional Name: N-[3-[5-amino-1-tert-butyl-6-carbamoyl-2-(methylthio)-7aH-thieno[2,3-d]pyrimidin-4-yl]phenyl]carbamic acid allyl ester Formula: C22H27N5O3S2 MolecularWeight: 473.61148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2C(=C(N=C1SC)C3=CC(=CC=C3)NC(=O)OCC=C)C(=C(S2)C(=O)N)N

Isomeric SMILES

CC(C)(C)N1C2C(=C(N=C1SC)C3=CC(=CC=C3)NC(=O)OCC=C)C(=C(S2)C(=O)N)N

InChI

InChI=1S/C22H27N5O3S2/c1-6-10-30-21(29)25-13-9-7-8-12(11-13)16-14-15(23)17(18(24)28)32-19(14)27(22(2,3)4)20(26-16)31-5/h6-9,11,19H,1,10,23H2,2-5H3,(H2,24,28)(H,25,29)