4-azanyl-1-[(1R,4S)-4-(hydroxymethyl)-3-methyl-4-phenyl-cyclopent-2-en-1-yl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[(1R,4S)-4-(hydroxymethyl)-3-methyl-4-phenyl-cyclopent-2-en-1-yl]pyrimidin-2-one Openeye Name: 4-amino-1-[(1R,4S)-4-(hydroxymethyl)-3-methyl-4-phenyl-cyclopent-2-en-1-yl]pyrimidin-2-one CAS Name: 4-amino-1-[(1R,4S)-4-(hydroxymethyl)-3-methyl-4-phenyl-1-cyclopent-2-enyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[(1R,4S)-4-(hydroxymethyl)-3-methyl-4-phenylcyclopent-2-en-1-yl]pyrimidin-2-one Traditional Name: 4-amino-1-[(1R,4S)-3-methyl-4-methylol-4-phenyl-cyclopent-2-en-1-yl]pyrimidin-2-one Formula: C17H19N3O2 MolecularWeight: 297.35166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(CC1(CO)C2=CC=CC=C2)N3C=CC(=NC3=O)N

Isomeric SMILES

CC1=C[C@@H](C[C@@]1(CO)C2=CC=CC=C2)N3C=CC(=NC3=O)N

InChI

InChI=1S/C17H19N3O2/c1-12-9-14(20-8-7-15(18)19-16(20)22)10-17(12,11-21)13-5-3-2-4-6-13/h2-9,14,21H,10-11H2,1H3,(H2,18,19,22)/t14-,17-/m0/s1