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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(SC3=NC=NC(=C23)NCC[NH3+])C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(SC3=NC=NC(=C23)NCC[NH3+])C

InChI

InChI=1S/C17H20N4OS/c1-3-22-13-6-4-12(5-7-13)14-11(2)23-17-15(14)16(19-9-8-18)20-10-21-17/h4-7,10H,3,8-9,18H2,1-2H3,(H,19,20,21)/p+1