2-(6-ethyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethylazanium

Systemtic Name: 2-(6-ethyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethylazanium Openeye Name: 2-(6-ethyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethylammonium CAS Name: 2-(6-ethyl-4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)ethylammonium IUPAC Name: 2-(6-ethyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)ethylazanium Traditional Name: 2-(6-ethyl-4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethylammonium Formula: C16H18N3OS+ MolecularWeight: 300.39862

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(S1)N=CN(C2=O)CC[NH3+])C3=CC=CC=C3

Isomeric SMILES

CCC1=C(C2=C(S1)N=CN(C2=O)CC[NH3+])C3=CC=CC=C3

InChI

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