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

Systemtic Name: (6S)-2-azanyl-6-[1-[3-(2-cyclopropylethynyl)phenyl]pyrazol-4-yl]-3,6-dimethyl-5H-pyrimidin-4-one Openeye Name: (6S)-2-amino-6-[1-[3-(2-cyclopropylethynyl)phenyl]pyrazol-4-yl]-3,6-dimethyl-5H-pyrimidin-4-one CAS Name: (6S)-2-amino-6-[1-[3-(2-cyclopropylethynyl)phenyl]-4-pyrazolyl]-3,6-dimethyl-5H-pyrimidin-4-one IUPAC Name: (6S)-2-amino-6-[1-[3-(2-cyclopropylethynyl)phenyl]pyrazol-4-yl]-3,6-dimethyl-5H-pyrimidin-4-one Traditional Name: (6S)-2-amino-6-[1-[3-(2-cyclopropylethynyl)phenyl]pyrazol-4-yl]-3,6-dimethyl-5H-pyrimidin-4-one Formula: C20H21N5O MolecularWeight: 347.41364

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)N(C(=N1)N)C)C2=CN(N=C2)C3=CC=CC(=C3)C#CC4CC4

Isomeric SMILES

C[C@]1(CC(=O)N(C(=N1)N)C)C2=CN(N=C2)C3=CC=CC(=C3)C#CC4CC4

InChI

InChI=1S/C20H21N5O/c1-20(11-18(26)24(2)19(21)23-20)16-12-22-25(13-16)17-5-3-4-15(10-17)9-8-14-6-7-14/h3-5,10,12-14H,6-7,11H2,1-2H3,(H2,21,23)/t20-/m0/s1