[4-(1,3-benzodioxol-5-ylmethylamino)-5-methyl-thieno[2,3-d]pyrimidin-6-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethylamino)-5-methyl-thieno[2,3-d]pyrimidin-6-yl]-pyrrolidin-1-yl-methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethylamino)-5-methyl-thieno[2,3-d]pyrimidin-6-yl]-pyrrolidin-1-yl-methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethylamino)-5-methyl-6-thieno[2,3-d]pyrimidinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethylamino)-5-methylthieno[2,3-d]pyrimidin-6-yl]-pyrrolidin-1-ylmethanone Traditional Name: [5-methyl-4-(piperonylamino)thieno[2,3-d]pyrimidin-6-yl]-pyrrolidino-methanone Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCC3=CC4=C(C=C3)OCO4)C(=O)N5CCCC5

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCC3=CC4=C(C=C3)OCO4)C(=O)N5CCCC5

InChI

InChI=1S/C20H20N4O3S/c1-12-16-18(21-9-13-4-5-14-15(8-13)27-11-26-14)22-10-23-19(16)28-17(12)20(25)24-6-2-3-7-24/h4-5,8,10H,2-3,6-7,9,11H2,1H3,(H,21,22,23)