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

Systemtic Name: 4-(furan-2-ylmethylamino)-5-methyl-N-(3-phenylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(2-furylmethylamino)-5-methyl-N-(3-phenylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(2-furanylmethylamino)-5-methyl-N-(3-phenylpropyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(furan-2-ylmethylamino)-5-methyl-N-(3-phenylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(2-furfurylamino)-5-methyl-N-(3-phenylpropyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O2S/c1-15-18-20(24-13-17-10-6-12-28-17)25-14-26-22(18)29-19(15)21(27)23-11-5-9-16-7-3-2-4-8-16/h2-4,6-8,10,12,14H,5,9,11,13H2,1H3,(H,23,27)(H,24,25,26)