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

Systemtic Name: 2-[[5-(3,4-dimethylphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]ethylazanium Openeye Name: 2-[[5-(3,4-dimethylphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]ethylammonium CAS Name: 2-[[5-(3,4-dimethylphenyl)-6-methyl-4-thieno[2,3-d]pyrimidinyl]amino]ethylammonium IUPAC Name: 2-[[5-(3,4-dimethylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]amino]ethylazanium Traditional Name: 2-[[5-(3,4-dimethylphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]ethylammonium Formula: C17H21N4S+ MolecularWeight: 313.44044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(SC3=NC=NC(=C23)NCC[NH3+])C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(SC3=NC=NC(=C23)NCC[NH3+])C)C

InChI

InChI=1S/C17H20N4S/c1-10-4-5-13(8-11(10)2)14-12(3)22-17-15(14)16(19-7-6-18)20-9-21-17/h4-5,8-9H,6-7,18H2,1-3H3,(H,19,20,21)/p+1