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

Systemtic Name: (6S)-2-azanyl-3,6-dimethyl-6-[3-methyl-1-(3-prop-1-ynylphenyl)pyrazol-4-yl]-5H-pyrimidin-4-one Openeye Name: (6S)-2-amino-3,6-dimethyl-6-[3-methyl-1-(3-prop-1-ynylphenyl)pyrazol-4-yl]-5H-pyrimidin-4-one CAS Name: (6S)-2-amino-3,6-dimethyl-6-[3-methyl-1-(3-prop-1-ynylphenyl)-4-pyrazolyl]-5H-pyrimidin-4-one IUPAC Name: (6S)-2-amino-3,6-dimethyl-6-[3-methyl-1-(3-prop-1-ynylphenyl)pyrazol-4-yl]-5H-pyrimidin-4-one Traditional Name: (6S)-2-amino-3,6-dimethyl-6-[3-methyl-1-(3-prop-1-ynylphenyl)pyrazol-4-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)N2C=C(C(=N2)C)C3(CC(=O)N(C(=N3)N)C)C

Isomeric SMILES

CC#CC1=CC(=CC=C1)N2C=C(C(=N2)C)[C@@]3(CC(=O)N(C(=N3)N)C)C

InChI

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