2-[(3-butyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl)carbonylamino]ethylazanium

Systemtic Name: 2-[(3-butyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl)carbonylamino]ethylazanium Openeye Name: 2-[(3-butyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carbonyl)amino]ethylammonium CAS Name: 2-[[(3-butyl-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinyl)-oxomethyl]amino]ethylammonium IUPAC Name: 2-[(3-butyl-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carbonyl)amino]ethylazanium Traditional Name: 2-[(3-butyl-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl)amino]ethylammonium Formula: C14H21N4O2S+ MolecularWeight: 309.40714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NCC[NH3+])C

Isomeric SMILES

CCCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NCC[NH3+])C

InChI

InChI=1S/C14H20N4O2S/c1-3-4-7-18-8-17-13-10(14(18)20)9(2)11(21-13)12(19)16-6-5-15/h8H,3-7,15H2,1-2H3,(H,16,19)/p+1