6-methyl-2-pent-4-ynyl-5-(phenylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-pent-4-ynyl-5-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 5-benzyl-6-methyl-2-pent-4-ynyl-1H-pyrimidin-4-one CAS Name: 6-methyl-2-pent-4-ynyl-5-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 5-benzyl-6-methyl-2-pent-4-ynyl-1H-pyrimidin-4-one Traditional Name: 5-benzyl-6-methyl-2-pent-4-ynyl-1H-pyrimidin-4-one Formula: C17H18N2O MolecularWeight: 266.33762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)CCCC#C)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=O)N=C(N1)CCCC#C)CC2=CC=CC=C2

InChI

InChI=1S/C17H18N2O/c1-3-4-6-11-16-18-13(2)15(17(20)19-16)12-14-9-7-5-8-10-14/h1,5,7-10H,4,6,11-12H2,2H3,(H,18,19,20)