1-(6-heptan-3-yl-4-oxidanylidene-1H-pyrimidin-2-yl)-3-pyridin-2-yl-urea

Systemtic Name: 1-(6-heptan-3-yl-4-oxidanylidene-1H-pyrimidin-2-yl)-3-pyridin-2-yl-urea Openeye Name: 1-[6-(1-ethylpentyl)-4-oxo-1H-pyrimidin-2-yl]-3-(2-pyridyl)urea CAS Name: 1-(6-heptan-3-yl-4-oxo-1H-pyrimidin-2-yl)-3-(2-pyridinyl)urea IUPAC Name: 1-(6-heptan-3-yl-4-oxo-1H-pyrimidin-2-yl)-3-pyridin-2-ylurea Traditional Name: 1-[6-(1-ethylpentyl)-4-keto-1H-pyrimidin-2-yl]-3-(2-pyridyl)urea Formula: C17H23N5O2 MolecularWeight: 329.39682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C1=CC(=O)N=C(N1)NC(=O)NC2=CC=CC=N2

Isomeric SMILES

CCCCC(CC)C1=CC(=O)N=C(N1)NC(=O)NC2=CC=CC=N2

InChI

InChI=1S/C17H23N5O2/c1-3-5-8-12(4-2)13-11-15(23)21-16(19-13)22-17(24)20-14-9-6-7-10-18-14/h6-7,9-12H,3-5,8H2,1-2H3,(H3,18,19,20,21,22,23,24)