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

Systemtic Name: [3-(6-aminocarbonyl-5-azanyl-1-tert-butyl-2-methylsulfanyl-7aH-thieno[2,3-d]pyrimidin-4-yl)phenyl] N,N-diethylcarbamate Openeye Name: [3-(5-amino-1-tert-butyl-6-carbamoyl-2-methylsulfanyl-7aH-thieno[2,3-d]pyrimidin-4-yl)phenyl] N,N-diethylcarbamate CAS Name: N,N-diethylcarbamic acid [3-[5-amino-1-tert-butyl-6-carbamoyl-2-(methylthio)-7aH-thieno[2,3-d]pyrimidin-4-yl]phenyl] ester IUPAC Name: [3-(5-amino-1-tert-butyl-6-carbamoyl-2-methylsulfanyl-7aH-thieno[2,3-d]pyrimidin-4-yl)phenyl] N,N-diethylcarbamate Traditional Name: N,N-diethylcarbamic acid [3-[5-amino-1-tert-butyl-6-carbamoyl-2-(methylthio)-7aH-thieno[2,3-d]pyrimidin-4-yl]phenyl] ester Formula: C23H31N5O3S2 MolecularWeight: 489.65394

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)OC1=CC=CC(=C1)C2=C3C(N(C(=N2)SC)C(C)(C)C)SC(=C3N)C(=O)N

Isomeric SMILES

CCN(CC)C(=O)OC1=CC=CC(=C1)C2=C3C(N(C(=N2)SC)C(C)(C)C)SC(=C3N)C(=O)N

InChI

InChI=1S/C23H31N5O3S2/c1-7-27(8-2)22(30)31-14-11-9-10-13(12-14)17-15-16(24)18(19(25)29)33-20(15)28(23(3,4)5)21(26-17)32-6/h9-12,20H,7-8,24H2,1-6H3,(H2,25,29)