3-[2-[2-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]ethanoylamino]propyl-diethyl-azanium

Systemtic Name: 3-[2-[2-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]ethanoylamino]propyl-diethyl-azanium Openeye Name: 3-[[2-[[2-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]acetyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[2-[[2-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-1-oxoethyl]amino]-1-oxoethyl]amino]propyl-diethylammonium IUPAC Name: 3-[[2-[[2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]acetyl]amino]propyl-diethylazanium Traditional Name: diethyl-[3-[[2-[[2-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]acetyl]amino]propyl]ammonium Formula: C19H30N5O3S+ MolecularWeight: 408.5382

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)CNC(=O)CN1C=NC2=C(C1=O)C(=C(S2)C)C

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)CNC(=O)CN1C=NC2=C(C1=O)C(=C(S2)C)C

InChI

InChI=1S/C19H29N5O3S/c1-5-23(6-2)9-7-8-20-15(25)10-21-16(26)11-24-12-22-18-17(19(24)27)13(3)14(4)28-18/h12H,5-11H2,1-4H3,(H,20,25)(H,21,26)/p+1