4-(1,3-benzodioxol-5-ylmethylamino)-N,5-dimethyl-N-phenethyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylamino)-N,5-dimethyl-N-phenethyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-ylmethylamino)-N,5-dimethyl-N-phenethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-N,5-dimethyl-N-phenethyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylamino)-N,5-dimethyl-N-phenethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N,5-dimethyl-N-phenethyl-4-(piperonylamino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCC3=CC4=C(C=C3)OCO4)C(=O)N(C)CCC5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCC3=CC4=C(C=C3)OCO4)C(=O)N(C)CCC5=CC=CC=C5

InChI

InChI=1S/C25H24N4O3S/c1-16-21-23(26-13-18-8-9-19-20(12-18)32-15-31-19)27-14-28-24(21)33-22(16)25(30)29(2)11-10-17-6-4-3-5-7-17/h3-9,12,14H,10-11,13,15H2,1-2H3,(H,26,27,28)