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

Systemtic Name: (4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-(phenylmethyl)-propan-2-yl-azanium Openeye Name: benzyl-isopropyl-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium CAS Name: (4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-(phenylmethyl)-propan-2-ylammonium IUPAC Name: benzyl-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]-propan-2-ylazanium Traditional Name: benzyl-isopropyl-[(4-keto-5-phenyl-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:

CC(C)[NH+](CC1=CC=CC=C1)CC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CC(C)[NH+](CC1=CC=CC=C1)CC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

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