4-(furan-2-ylmethylamino)-5-methyl-N-(3-pyridin-4-ylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-(furan-2-ylmethylamino)-5-methyl-N-(3-pyridin-4-ylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(2-furylmethylamino)-5-methyl-N-[3-(4-pyridyl)propyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(2-furanylmethylamino)-5-methyl-N-(3-pyridin-4-ylpropyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(furan-2-ylmethylamino)-5-methyl-N-(3-pyridin-4-ylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(2-furfurylamino)-5-methyl-N-[3-(4-pyridyl)propyl]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCC3=CC=CO3)C(=O)NCCCC4=CC=NC=C4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCC3=CC=CO3)C(=O)NCCCC4=CC=NC=C4

InChI

InChI=1S/C21H21N5O2S/c1-14-17-19(24-12-16-5-3-11-28-16)25-13-26-21(17)29-18(14)20(27)23-8-2-4-15-6-9-22-10-7-15/h3,5-7,9-11,13H,2,4,8,12H2,1H3,(H,23,27)(H,24,25,26)