(5,6-dimethyl-3-pentan-3-yl-3,4-dihydro-2H-thieno[2,3-d]pyrimidin-3-ium-1-yl)-(furan-2-yl)methanone

Systemtic Name: (5,6-dimethyl-3-pentan-3-yl-3,4-dihydro-2H-thieno[2,3-d]pyrimidin-3-ium-1-yl)-(furan-2-yl)methanone Openeye Name: [3-(1-ethylpropyl)-5,6-dimethyl-3,4-dihydro-2H-thieno[2,3-d]pyrimidin-3-ium-1-yl]-(2-furyl)methanone CAS Name: (5,6-dimethyl-3-pentan-3-yl-3,4-dihydro-2H-thieno[2,3-d]pyrimidin-3-ium-1-yl)-(2-furanyl)methanone IUPAC Name: (5,6-dimethyl-3-pentan-3-yl-3,4-dihydro-2H-thieno[2,3-d]pyrimidin-3-ium-1-yl)-(furan-2-yl)methanone Traditional Name: [3-(1-ethylpropyl)-5,6-dimethyl-3,4-dihydro-2H-thieno[2,3-d]pyrimidin-3-ium-1-yl]-(2-furyl)methanone Formula: C18H25N2O2S+ MolecularWeight: 333.4683

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH+]1CC2=C(N(C1)C(=O)C3=CC=CO3)SC(=C2C)C

Isomeric SMILES

CCC(CC)[NH+]1CC2=C(N(C1)C(=O)C3=CC=CO3)SC(=C2C)C

InChI

InChI=1S/C18H24N2O2S/c1-5-14(6-2)19-10-15-12(3)13(4)23-18(15)20(11-19)17(21)16-8-7-9-22-16/h7-9,14H,5-6,10-11H2,1-4H3/p+1