2-[2-(cyclohexen-1-yl)ethylamino]-4-(cyclohexylmethylamino)-N-phenethyl-pyrimidine-5-carboxamide

Systemtic Name: 2-[2-(cyclohexen-1-yl)ethylamino]-4-(cyclohexylmethylamino)-N-phenethyl-pyrimidine-5-carboxamide Openeye Name: 2-[2-(cyclohexen-1-yl)ethylamino]-4-(cyclohexylmethylamino)-N-phenethyl-pyrimidine-5-carboxamide CAS Name: 2-[2-(1-cyclohexenyl)ethylamino]-4-(cyclohexylmethylamino)-N-phenethyl-5-pyrimidinecarboxamide IUPAC Name: 2-[2-(cyclohexen-1-yl)ethylamino]-4-(cyclohexylmethylamino)-N-phenethylpyrimidine-5-carboxamide Traditional Name: 2-[2-(cyclohexen-1-yl)ethylamino]-4-(cyclohexylmethylamino)-N-phenethyl-pyrimidine-5-carboxamide Formula: C28H39N5O MolecularWeight: 461.64216

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC2=NC(=NC=C2C(=O)NCCC3=CC=CC=C3)NCCC4=CCCCC4

Isomeric SMILES

C1CCC(CC1)CNC2=NC(=NC=C2C(=O)NCCC3=CC=CC=C3)NCCC4=CCCCC4

InChI

InChI=1S/C28H39N5O/c34-27(29-18-16-22-10-4-1-5-11-22)25-21-32-28(30-19-17-23-12-6-2-7-13-23)33-26(25)31-20-24-14-8-3-9-15-24/h1,4-5,10-12,21,24H,2-3,6-9,13-20H2,(H,29,34)(H2,30,31,32,33)