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

Systemtic Name: phenyl N-[3-(6-aminocarbonyl-5-azanyl-1-tert-butyl-2-methylsulfanyl-7aH-thieno[2,3-d]pyrimidin-4-yl)phenyl]carbamate Openeye Name: phenyl 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 phenyl ester IUPAC Name: phenyl 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 phenyl ester Formula: C25H27N5O3S2 MolecularWeight: 509.64358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2C(=C(N=C1SC)C3=CC(=CC=C3)NC(=O)OC4=CC=CC=C4)C(=C(S2)C(=O)N)N

Isomeric SMILES

CC(C)(C)N1C2C(=C(N=C1SC)C3=CC(=CC=C3)NC(=O)OC4=CC=CC=C4)C(=C(S2)C(=O)N)N

InChI

InChI=1S/C25H27N5O3S2/c1-25(2,3)30-22-17(18(26)20(35-22)21(27)31)19(29-23(30)34-4)14-9-8-10-15(13-14)28-24(32)33-16-11-6-5-7-12-16/h5-13,22H,26H2,1-4H3,(H2,27,31)(H,28,32)