2-[[6-ethyl-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethylazanium

Systemtic Name: 2-[[6-ethyl-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethylazanium Openeye Name: 2-[[6-ethyl-5-(4-isopropylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethylammonium CAS Name: 2-[[6-ethyl-5-(4-propan-2-ylphenyl)-4-thieno[2,3-d]pyrimidinyl]amino]ethylammonium IUPAC Name: 2-[[6-ethyl-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethylazanium Traditional Name: 2-[(6-ethyl-5-p-cumenyl-thieno[2,3-d]pyrimidin-4-yl)amino]ethylammonium Formula: C19H25N4S+ MolecularWeight: 341.4936

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N=CN=C2S1)NCC[NH3+])C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCC1=C(C2=C(N=CN=C2S1)NCC[NH3+])C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C19H24N4S/c1-4-15-16(14-7-5-13(6-8-14)12(2)3)17-18(21-10-9-20)22-11-23-19(17)24-15/h5-8,11-12H,4,9-10,20H2,1-3H3,(H,21,22,23)/p+1