2-[5-(diethylamino)pentan-2-ylamino]-6-(4-fluorophenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-[5-(diethylamino)pentan-2-ylamino]-6-(4-fluorophenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-[[4-(diethylamino)-1-methyl-butyl]amino]-6-(4-fluorophenyl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-[5-(diethylamino)pentan-2-ylamino]-6-(4-fluorophenyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-[5-(diethylamino)pentan-2-ylamino]-6-(4-fluorophenyl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 2-[[4-(diethylamino)-1-methyl-butyl]amino]-6-(4-fluorophenyl)-4-keto-1H-pyrimidine-5-carbonitrile Formula: C20H26FN5O MolecularWeight: 371.451743

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC1=NC(=O)C(=C(N1)C2=CC=C(C=C2)F)C#N

Isomeric SMILES

CCN(CC)CCCC(C)NC1=NC(=O)C(=C(N1)C2=CC=C(C=C2)F)C#N

InChI

InChI=1S/C20H26FN5O/c1-4-26(5-2)12-6-7-14(3)23-20-24-18(17(13-22)19(27)25-20)15-8-10-16(21)11-9-15/h8-11,14H,4-7,12H2,1-3H3,(H2,23,24,25,27)