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

Systemtic Name: (5R,6S)-2-azanyl-5-cyclopropyl-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)pyridin-4-yl]-5H-pyrimidin-4-one Openeye Name: (5R,6S)-2-amino-5-cyclopropyl-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridyl]-5H-pyrimidin-4-one CAS Name: (5R,6S)-2-amino-5-cyclopropyl-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridinyl]-5H-pyrimidin-4-one IUPAC Name: (5R,6S)-2-amino-5-cyclopropyl-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)pyridin-4-yl]-5H-pyrimidin-4-one Traditional Name: (5R,6S)-2-amino-5-cyclopropyl-3,6-dimethyl-6-[2-(3-prop-1-ynylphenyl)-4-pyridyl]-5H-pyrimidin-4-one Formula: C23H24N4O MolecularWeight: 372.46286

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC(=CC=C1)C2=NC=CC(=C2)C3(C(C(=O)N(C(=N3)N)C)C4CC4)C

Isomeric SMILES

CC#CC1=CC(=CC=C1)C2=NC=CC(=C2)[C@@]3([C@H](C(=O)N(C(=N3)N)C)C4CC4)C

InChI

InChI=1S/C23H24N4O/c1-4-6-15-7-5-8-17(13-15)19-14-18(11-12-25-19)23(2)20(16-9-10-16)21(28)27(3)22(24)26-23/h5,7-8,11-14,16,20H,9-10H2,1-3H3,(H2,24,26)/t20-,23+/m0/s1