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

Systemtic Name: 5-azanyl-1-tert-butyl-4-[3-[(4-methylphenyl)sulfonylamino]phenyl]-2-methylsulfanyl-7aH-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 5-amino-1-tert-butyl-2-methylsulfanyl-4-[3-(p-tolylsulfonylamino)phenyl]-7aH-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 5-amino-1-tert-butyl-4-[3-[(4-methylphenyl)sulfonylamino]phenyl]-2-(methylthio)-7aH-thieno[2,3-d]pyrimidine-6-carboxamide IUPAC Name: 5-amino-1-tert-butyl-4-[3-[(4-methylphenyl)sulfonylamino]phenyl]-2-methylsulfanyl-7aH-thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 5-amino-1-tert-butyl-2-(methylthio)-4-[3-(tosylamino)phenyl]-7aH-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C25H29N5O3S3 MolecularWeight: 543.72446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=C4C(N(C(=N3)SC)C(C)(C)C)SC(=C4N)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=C4C(N(C(=N3)SC)C(C)(C)C)SC(=C4N)C(=O)N

InChI

InChI=1S/C25H29N5O3S3/c1-14-9-11-17(12-10-14)36(32,33)29-16-8-6-7-15(13-16)20-18-19(26)21(22(27)31)35-23(18)30(25(2,3)4)24(28-20)34-5/h6-13,23,29H,26H2,1-5H3,(H2,27,31)