2-cyclopropyl-4,5-dimethyl-N-[4-(3-methylbutanoylamino)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2-cyclopropyl-4,5-dimethyl-N-[4-(3-methylbutanoylamino)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-cyclopropyl-4,5-dimethyl-N-[4-(3-methylbutanoylamino)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-cyclopropyl-4,5-dimethyl-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2-cyclopropyl-4,5-dimethyl-N-[4-(3-methylbutanoylamino)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-cyclopropyl-N-[4-(isovalerylamino)phenyl]-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)C)C3CC3)C(=O)NC4=CC=C(C=C4)NC(=O)CC(C)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)C)C3CC3)C(=O)NC4=CC=C(C=C4)NC(=O)CC(C)C

InChI

InChI=1S/C23H26N4O2S/c1-12(2)11-18(28)25-16-7-9-17(10-8-16)26-22(29)20-13(3)19-14(4)24-21(15-5-6-15)27-23(19)30-20/h7-10,12,15H,5-6,11H2,1-4H3,(H,25,28)(H,26,29)