(6S)-2-azanyl-6-[5-fluoranyl-4-(5-prop-1-ynylpyridin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one

Systemtic Name: (6S)-2-azanyl-6-[5-fluoranyl-4-(5-prop-1-ynylpyridin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one Openeye Name: (6S)-2-amino-6-[5-fluoro-4-(5-prop-1-ynyl-3-pyridyl)-2-thienyl]-3,6-dimethyl-5H-pyrimidin-4-one CAS Name: (6S)-2-amino-6-[5-fluoro-4-(5-prop-1-ynyl-3-pyridinyl)-2-thiophenyl]-3,6-dimethyl-5H-pyrimidin-4-one IUPAC Name: (6S)-2-amino-6-[5-fluoro-4-(5-prop-1-ynylpyridin-3-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one Traditional Name: (6S)-2-amino-6-[5-fluoro-4-(5-prop-1-ynyl-3-pyridyl)-2-thienyl]-3,6-dimethyl-5H-pyrimidin-4-one Formula: C18H17FN4OS MolecularWeight: 356.417183

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC(=CN=C1)C2=C(SC(=C2)C3(CC(=O)N(C(=N3)N)C)C)F

Isomeric SMILES

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

InChI

InChI=1S/C18H17FN4OS/c1-4-5-11-6-12(10-21-9-11)13-7-14(25-16(13)19)18(2)8-15(24)23(3)17(20)22-18/h6-7,9-10H,8H2,1-3H3,(H2,20,22)/t18-/m0/s1