4-(1,3-benzodioxol-5-ylmethylamino)-5-methyl-N-(1-thiophen-3-ylpropan-2-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylamino)-5-methyl-N-(1-thiophen-3-ylpropan-2-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-ylmethylamino)-5-methyl-N-[1-methyl-2-(3-thienyl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-5-methyl-N-[1-(3-thiophenyl)propan-2-yl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylamino)-5-methyl-N-(1-thiophen-3-ylpropan-2-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 5-methyl-N-[1-methyl-2-(3-thienyl)ethyl]-4-(piperonylamino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C23H22N4O3S2 MolecularWeight: 466.57578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCC3=CC4=C(C=C3)OCO4)C(=O)NC(C)CC5=CSC=C5

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCC3=CC4=C(C=C3)OCO4)C(=O)NC(C)CC5=CSC=C5

InChI

InChI=1S/C23H22N4O3S2/c1-13(7-16-5-6-31-10-16)27-22(28)20-14(2)19-21(25-11-26-23(19)32-20)24-9-15-3-4-17-18(8-15)30-12-29-17/h3-6,8,10-11,13H,7,9,12H2,1-2H3,(H,27,28)(H,24,25,26)