[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-[(3-methyl-1-prop-2-enyl-pyrazol-4-yl)methyl]azanium

Systemtic Name: [(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-[(3-methyl-1-prop-2-enyl-pyrazol-4-yl)methyl]azanium Openeye Name: (1-allyl-3-methyl-pyrazol-4-yl)methyl-[(5S)-7,7-dimethyl-2-morpholino-6,8-dihydro-5H-quinazolin-5-yl]ammonium CAS Name: [(5S)-7,7-dimethyl-2-(4-morpholinyl)-6,8-dihydro-5H-quinazolin-5-yl]-[(3-methyl-1-prop-2-enyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-[(3-methyl-1-prop-2-enylpyrazol-4-yl)methyl]azanium Traditional Name: (1-allyl-3-methyl-pyrazol-4-yl)methyl-[(5S)-7,7-dimethyl-2-morpholino-6,8-dihydro-5H-quinazolin-5-yl]ammonium Formula: C22H33N6O+ MolecularWeight: 397.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C[NH2+]C2CC(CC3=NC(=NC=C23)N4CCOCC4)(C)C)CC=C

Isomeric SMILES

CC1=NN(C=C1C[NH2+][C@H]2CC(CC3=NC(=NC=C23)N4CCOCC4)(C)C)CC=C

InChI

InChI=1S/C22H32N6O/c1-5-6-28-15-17(16(2)26-28)13-23-19-11-22(3,4)12-20-18(19)14-24-21(25-20)27-7-9-29-10-8-27/h5,14-15,19,23H,1,6-13H2,2-4H3/p+1/t19-/m0/s1