2-methoxyethyl-[(4-oxidanylidene-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium

Systemtic Name: 2-methoxyethyl-[(4-oxidanylidene-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium Openeye Name: 2-methoxyethyl-[(4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium CAS Name: 2-methoxyethyl-[(4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium IUPAC Name: 2-methoxyethyl-[(4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium Traditional Name: (4-keto-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-(2-methoxyethyl)ammonium Formula: C16H18N3O2S+ MolecularWeight: 316.39802

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH2+]CC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N1

Isomeric SMILES

COCC[NH2+]CC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N1

InChI

InChI=1S/C16H17N3O2S/c1-21-8-7-17-10-14-18-15(20)12-9-13(22-16(12)19-14)11-5-3-2-4-6-11/h2-6,9,17H,7-8,10H2,1H3,(H,18,19,20)/p+1