6-(4-methoxyphenyl)-2-(octylamino)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-2-(octylamino)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-methoxyphenyl)-2-(octylamino)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-methoxyphenyl)-2-(octylamino)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-methoxyphenyl)-2-(octylamino)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-6-(4-methoxyphenyl)-2-(octylamino)-1H-pyrimidine-5-carbonitrile Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=NC(=O)C(=C(N1)C2=CC=C(C=C2)OC)C#N

Isomeric SMILES

CCCCCCCCNC1=NC(=O)C(=C(N1)C2=CC=C(C=C2)OC)C#N

InChI

InChI=1S/C20H26N4O2/c1-3-4-5-6-7-8-13-22-20-23-18(17(14-21)19(25)24-20)15-9-11-16(26-2)12-10-15/h9-12H,3-8,13H2,1-2H3,(H2,22,23,24,25)