2-tert-butyl-4,5-dimethyl-N-[3-(4-phenylpiperazin-1-yl)propyl]thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2-tert-butyl-4,5-dimethyl-N-[3-(4-phenylpiperazin-1-yl)propyl]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-tert-butyl-4,5-dimethyl-N-[3-(4-phenylpiperazin-1-yl)propyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-tert-butyl-4,5-dimethyl-N-[3-(4-phenyl-1-piperazinyl)propyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2-tert-butyl-4,5-dimethyl-N-[3-(4-phenylpiperazin-1-yl)propyl]thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-tert-butyl-4,5-dimethyl-N-[3-(4-phenylpiperazino)propyl]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C26H35N5OS MolecularWeight: 465.654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)C)C(C)(C)C)C(=O)NCCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)C)C(C)(C)C)C(=O)NCCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H35N5OS/c1-18-21-19(2)28-25(26(3,4)5)29-24(21)33-22(18)23(32)27-12-9-13-30-14-16-31(17-15-30)20-10-7-6-8-11-20/h6-8,10-11H,9,12-17H2,1-5H3,(H,27,32)