[(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-[(2-ethylpyrimidin-5-yl)methyl]azanium

Systemtic Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-[(2-ethylpyrimidin-5-yl)methyl]azanium Openeye Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-[(2-ethylpyrimidin-5-yl)methyl]ammonium CAS Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-[(2-ethyl-5-pyrimidinyl)methyl]ammonium IUPAC Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-[(2-ethylpyrimidin-5-yl)methyl]azanium Traditional Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-[(2-ethylpyrimidin-5-yl)methyl]ammonium Formula: C21H32N5+ MolecularWeight: 354.51228

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=C(C=N1)C[NH2+]C2CC(CC3=NC(=NC=C23)C(C)(C)C)(C)C

Isomeric SMILES

CCC1=NC=C(C=N1)C[NH2+][C@H]2CC(CC3=NC(=NC=C23)C(C)(C)C)(C)C

InChI

InChI=1S/C21H31N5/c1-7-18-23-11-14(12-24-18)10-22-16-8-21(5,6)9-17-15(16)13-25-19(26-17)20(2,3)4/h11-13,16,22H,7-10H2,1-6H3/p+1/t16-/m0/s1