cyclohexyl-methyl-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium

Systemtic Name: cyclohexyl-methyl-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium Openeye Name: cyclohexyl-methyl-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium CAS Name: cyclohexyl-methyl-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium IUPAC Name: cyclohexyl-methyl-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium Traditional Name: cyclohexyl-[(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-methyl-ammonium Formula: C20H24N3OS+ MolecularWeight: 354.48906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1)C4CCCCC4

Isomeric SMILES

C[NH+](CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1)C4CCCCC4

InChI

InChI=1S/C20H23N3OS/c1-23(15-10-6-3-7-11-15)12-17-21-19(24)18-16(13-25-20(18)22-17)14-8-4-2-5-9-14/h2,4-5,8-9,13,15H,3,6-7,10-12H2,1H3,(H,21,22,24)/p+1