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

Systemtic Name: [3-(6-aminocarbonyl-5-azanyl-1-tert-butyl-2-methylsulfanyl-7aH-thieno[2,3-d]pyrimidin-4-yl)phenyl] prop-2-enyl carbonate Openeye Name: allyl [3-(5-amino-1-tert-butyl-6-carbamoyl-2-methylsulfanyl-7aH-thieno[2,3-d]pyrimidin-4-yl)phenyl] carbonate CAS Name: carbonic acid [3-[5-amino-1-tert-butyl-6-carbamoyl-2-(methylthio)-7aH-thieno[2,3-d]pyrimidin-4-yl]phenyl] prop-2-enyl ester IUPAC Name: [3-(5-amino-1-tert-butyl-6-carbamoyl-2-methylsulfanyl-7aH-thieno[2,3-d]pyrimidin-4-yl)phenyl] prop-2-enyl carbonate Traditional Name: carbonic acid allyl [3-[5-amino-1-tert-butyl-6-carbamoyl-2-(methylthio)-7aH-thieno[2,3-d]pyrimidin-4-yl]phenyl] ester Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O4S2/c1-6-10-29-21(28)30-13-9-7-8-12(11-13)16-14-15(23)17(18(24)27)32-19(14)26(22(2,3)4)20(25-16)31-5/h6-9,11,19H,1,10,23H2,2-5H3,(H2,24,27)