5-azanyl-1-tert-butyl-2-methylsulfanyl-4-[3-(2-thiomorpholin-4-ylethanoylamino)phenyl]-7aH-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 5-azanyl-1-tert-butyl-2-methylsulfanyl-4-[3-(2-thiomorpholin-4-ylethanoylamino)phenyl]-7aH-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 5-amino-1-tert-butyl-2-methylsulfanyl-4-[3-[(2-thiomorpholinoacetyl)amino]phenyl]-7aH-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 5-amino-1-tert-butyl-2-(methylthio)-4-[3-[(1-oxo-2-thiomorpholin-4-ylethyl)amino]phenyl]-7aH-thieno[2,3-d]pyrimidine-6-carboxamide IUPAC Name: 5-amino-1-tert-butyl-2-methylsulfanyl-4-[3-[(2-thiomorpholin-4-ylacetyl)amino]phenyl]-7aH-thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 5-amino-1-tert-butyl-2-(methylthio)-4-[3-[(2-thiomorpholinoacetyl)amino]phenyl]-7aH-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C24H32N6O2S3 MolecularWeight: 532.74488

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)CN4CCSCC4)C(=C(S2)C(=O)N)N

Isomeric SMILES

CC(C)(C)N1C2C(=C(N=C1SC)C3=CC(=CC=C3)NC(=O)CN4CCSCC4)C(=C(S2)C(=O)N)N

InChI

InChI=1S/C24H32N6O2S3/c1-24(2,3)30-22-17(18(25)20(35-22)21(26)32)19(28-23(30)33-4)14-6-5-7-15(12-14)27-16(31)13-29-8-10-34-11-9-29/h5-7,12,22H,8-11,13,25H2,1-4H3,(H2,26,32)(H,27,31)