(2-methylsulfanylpyrimidin-5-yl)methyl-[(5S)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]azanium

Systemtic Name: (2-methylsulfanylpyrimidin-5-yl)methyl-[(5S)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]azanium Openeye Name: (2-methylsulfanylpyrimidin-5-yl)methyl-[(5S)-2-(3-pyridyl)-5,6,7,8-tetrahydroquinazolin-5-yl]ammonium CAS Name: [2-(methylthio)-5-pyrimidinyl]methyl-[(5S)-2-(3-pyridinyl)-5,6,7,8-tetrahydroquinazolin-5-yl]ammonium IUPAC Name: (2-methylsulfanylpyrimidin-5-yl)methyl-[(5S)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]azanium Traditional Name: [2-(methylthio)pyrimidin-5-yl]methyl-[(5S)-2-(3-pyridyl)-5,6,7,8-tetrahydroquinazolin-5-yl]ammonium Formula: C19H21N6S+ MolecularWeight: 365.47524

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C=N1)C[NH2+]C2CCCC3=NC(=NC=C23)C4=CN=CC=C4

Isomeric SMILES

CSC1=NC=C(C=N1)C[NH2+][C@H]2CCCC3=NC(=NC=C23)C4=CN=CC=C4

InChI

InChI=1S/C19H20N6S/c1-26-19-23-9-13(10-24-19)8-21-16-5-2-6-17-15(16)12-22-18(25-17)14-4-3-7-20-11-14/h3-4,7,9-12,16,21H,2,5-6,8H2,1H3/p+1/t16-/m0/s1