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

Systemtic Name: 3-[[5-(4-ethylphenyl)-2-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propylazanium Openeye Name: 3-[[5-(4-ethylphenyl)-2-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propylammonium CAS Name: 3-[[5-(4-ethylphenyl)-2-methyl-4-thieno[2,3-d]pyrimidinyl]amino]propylammonium IUPAC Name: 3-[[5-(4-ethylphenyl)-2-methylthieno[2,3-d]pyrimidin-4-yl]amino]propylazanium Traditional Name: 3-[[5-(4-ethylphenyl)-2-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propylammonium Formula: C18H23N4S+ MolecularWeight: 327.46702

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC3=NC(=NC(=C23)NCCC[NH3+])C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC3=NC(=NC(=C23)NCCC[NH3+])C

InChI

InChI=1S/C18H22N4S/c1-3-13-5-7-14(8-6-13)15-11-23-18-16(15)17(20-10-4-9-19)21-12(2)22-18/h5-8,11H,3-4,9-10,19H2,1-2H3,(H,20,21,22)/p+1