2-[[5,6-dimethyl-2-(phenoxymethyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethylazanium

Systemtic Name: 2-[[5,6-dimethyl-2-(phenoxymethyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethylazanium Openeye Name: 2-[[5,6-dimethyl-2-(phenoxymethyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethylammonium CAS Name: 2-[[5,6-dimethyl-2-(phenoxymethyl)-4-thieno[2,3-d]pyrimidinyl]amino]ethylammonium IUPAC Name: 2-[[5,6-dimethyl-2-(phenoxymethyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethylazanium Traditional Name: 2-[[5,6-dimethyl-2-(phenoxymethyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethylammonium Formula: C17H21N4OS+ MolecularWeight: 329.43984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NCC[NH3+])COC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NCC[NH3+])COC3=CC=CC=C3)C

InChI

InChI=1S/C17H20N4OS/c1-11-12(2)23-17-15(11)16(19-9-8-18)20-14(21-17)10-22-13-6-4-3-5-7-13/h3-7H,8-10,18H2,1-2H3,(H,19,20,21)/p+1