5-[[4-(diethylamino)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]-N-(phenylmethyl)furan-2-carboxamide

Systemtic Name: 5-[[4-(diethylamino)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]-N-(phenylmethyl)furan-2-carboxamide Openeye Name: N-benzyl-5-[[4-(diethylamino)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]furan-2-carboxamide CAS Name: 5-[[[4-(diethylamino)-6-ethyl-2-pyrimidinyl]thio]methyl]-N-(phenylmethyl)-2-furancarboxamide IUPAC Name: N-benzyl-5-[[4-(diethylamino)-6-ethylpyrimidin-2-yl]sulfanylmethyl]furan-2-carboxamide Traditional Name: N-benzyl-5-[[[4-(diethylamino)-6-ethyl-pyrimidin-2-yl]thio]methyl]-2-furamide Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3=CC=CC=C3)N(CC)CC

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3=CC=CC=C3)N(CC)CC

InChI

InChI=1S/C23H28N4O2S/c1-4-18-14-21(27(5-2)6-3)26-23(25-18)30-16-19-12-13-20(29-19)22(28)24-15-17-10-8-7-9-11-17/h7-14H,4-6,15-16H2,1-3H3,(H,24,28)