3-[[5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propylazanium

Systemtic Name: 3-[[5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propylazanium Openeye Name: 3-[[5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propylammonium CAS Name: 3-[[5-(3,4-dimethoxyphenyl)-4-thieno[2,3-d]pyrimidinyl]amino]propylammonium IUPAC Name: 3-[[5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propylazanium Traditional Name: 3-[[5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propylammonium Formula: C17H21N4O2S+ MolecularWeight: 345.43924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC3=NC=NC(=C23)NCCC[NH3+])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC3=NC=NC(=C23)NCCC[NH3+])OC

InChI

InChI=1S/C17H20N4O2S/c1-22-13-5-4-11(8-14(13)23-2)12-9-24-17-15(12)16(20-10-21-17)19-7-3-6-18/h4-5,8-10H,3,6-7,18H2,1-2H3,(H,19,20,21)/p+1