(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-bis(phenylmethyl)azanium

Systemtic Name: (5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-bis(phenylmethyl)azanium Openeye Name: dibenzyl-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium CAS Name: (5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-bis(phenylmethyl)ammonium IUPAC Name: dibenzyl-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium Traditional Name: dibenzyl-[(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium Formula: C23H24N3OS+ MolecularWeight: 390.52116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C[NH+](CC3=CC=CC=C3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)C[NH+](CC3=CC=CC=C3)CC4=CC=CC=C4)C

InChI

InChI=1S/C23H23N3OS/c1-16-17(2)28-23-21(16)22(27)24-20(25-23)15-26(13-18-9-5-3-6-10-18)14-19-11-7-4-8-12-19/h3-12H,13-15H2,1-2H3,(H,24,25,27)/p+1