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

Systemtic Name: 2-[[2-methyl-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethylazanium Openeye Name: 2-[[5-(4-isopropylphenyl)-2-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]ethylammonium CAS Name: 2-[[2-methyl-5-(4-propan-2-ylphenyl)-4-thieno[2,3-d]pyrimidinyl]amino]ethylammonium IUPAC Name: 2-[[2-methyl-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethylazanium Traditional Name: 2-[(2-methyl-5-p-cumenyl-thieno[2,3-d]pyrimidin-4-yl)amino]ethylammonium Formula: C18H23N4S+ MolecularWeight: 327.46702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC=C(C=C3)C(C)C)NCC[NH3+]

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=C(C=C3)C(C)C)NCC[NH3+]

InChI

InChI=1S/C18H22N4S/c1-11(2)13-4-6-14(7-5-13)15-10-23-18-16(15)17(20-9-8-19)21-12(3)22-18/h4-7,10-11H,8-9,19H2,1-3H3,(H,20,21,22)/p+1