3-ethoxypropyl-[(1R)-1-(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)ethyl]azanium

Systemtic Name: 3-ethoxypropyl-[(1R)-1-(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)ethyl]azanium Openeye Name: 3-ethoxypropyl-[(1R)-1-[4-oxo-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]ethyl]ammonium CAS Name: 3-ethoxypropyl-[(1R)-1-(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)ethyl]ammonium IUPAC Name: 3-ethoxypropyl-[(1R)-1-(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)ethyl]azanium Traditional Name: 3-ethoxypropyl-[(1R)-1-[4-keto-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]ethyl]ammonium Formula: C17H22N3O2S2+ MolecularWeight: 364.50548

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC[NH2+]C(C)C1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1

Isomeric SMILES

CCOCCC[NH2+][C@H](C)C1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1

InChI

InChI=1S/C17H21N3O2S2/c1-3-22-8-5-7-18-11(2)15-19-16(21)14-12(10-24-17(14)20-15)13-6-4-9-23-13/h4,6,9-11,18H,3,5,7-8H2,1-2H3,(H,19,20,21)/p+1/t11-/m1/s1