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

Systemtic Name: (6S)-2-azanyl-6-[5-(3-ethynylphenyl)-1-methyl-pyrazol-3-yl]-3,6-dimethyl-5H-pyrimidin-4-one Openeye Name: (6S)-2-amino-6-[5-(3-ethynylphenyl)-1-methyl-pyrazol-3-yl]-3,6-dimethyl-5H-pyrimidin-4-one CAS Name: (6S)-2-amino-6-[5-(3-ethynylphenyl)-1-methyl-3-pyrazolyl]-3,6-dimethyl-5H-pyrimidin-4-one IUPAC Name: (6S)-2-amino-6-[5-(3-ethynylphenyl)-1-methylpyrazol-3-yl]-3,6-dimethyl-5H-pyrimidin-4-one Traditional Name: (6S)-2-amino-6-[5-(3-ethynylphenyl)-1-methyl-pyrazol-3-yl]-3,6-dimethyl-5H-pyrimidin-4-one Formula: C18H19N5O MolecularWeight: 321.37636

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)N(C(=N1)N)C)C2=NN(C(=C2)C3=CC=CC(=C3)C#C)C

Isomeric SMILES

C[C@]1(CC(=O)N(C(=N1)N)C)C2=NN(C(=C2)C3=CC=CC(=C3)C#C)C

InChI

InChI=1S/C18H19N5O/c1-5-12-7-6-8-13(9-12)14-10-15(21-23(14)4)18(2)11-16(24)22(3)17(19)20-18/h1,6-10H,11H2,2-4H3,(H2,19,20)/t18-/m0/s1