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

Systemtic Name: (4-oxidanylidene-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-propyl-azanium Openeye Name: (4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-propyl-ammonium CAS Name: (4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-propylammonium IUPAC Name: (4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-propylazanium Traditional Name: (4-keto-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-propyl-ammonium Formula: C16H18N3OS+ MolecularWeight: 300.39862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3OS/c1-2-8-17-10-14-18-15(20)12-9-13(21-16(12)19-14)11-6-4-3-5-7-11/h3-7,9,17H,2,8,10H2,1H3,(H,18,19,20)/p+1