(6S)-2-azanyl-3,6-dimethyl-6-[1-methyl-5-(3-prop-1-ynylphenyl)pyrazol-3-yl]-5H-pyrimidin-4-one

Systemtic Name: (6S)-2-azanyl-3,6-dimethyl-6-[1-methyl-5-(3-prop-1-ynylphenyl)pyrazol-3-yl]-5H-pyrimidin-4-one Openeye Name: (6S)-2-amino-3,6-dimethyl-6-[1-methyl-5-(3-prop-1-ynylphenyl)pyrazol-3-yl]-5H-pyrimidin-4-one CAS Name: (6S)-2-amino-3,6-dimethyl-6-[1-methyl-5-(3-prop-1-ynylphenyl)-3-pyrazolyl]-5H-pyrimidin-4-one IUPAC Name: (6S)-2-amino-3,6-dimethyl-6-[1-methyl-5-(3-prop-1-ynylphenyl)pyrazol-3-yl]-5H-pyrimidin-4-one Traditional Name: (6S)-2-amino-3,6-dimethyl-6-[1-methyl-5-(3-prop-1-ynylphenyl)pyrazol-3-yl]-5H-pyrimidin-4-one Formula: C19H21N5O MolecularWeight: 335.40294

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC(=CC=C1)C2=CC(=NN2C)C3(CC(=O)N(C(=N3)N)C)C

Isomeric SMILES

CC#CC1=CC(=CC=C1)C2=CC(=NN2C)[C@@]3(CC(=O)N(C(=N3)N)C)C

InChI

InChI=1S/C19H21N5O/c1-5-7-13-8-6-9-14(10-13)15-11-16(22-24(15)4)19(2)12-17(25)23(3)18(20)21-19/h6,8-11H,12H2,1-4H3,(H2,20,21)/t19-/m0/s1