2-[3-(dimethylamino)propylamino]-4-(phenethylamino)-N-(phenylmethyl)pyrimidine-5-carboxamide

Systemtic Name: 2-[3-(dimethylamino)propylamino]-4-(phenethylamino)-N-(phenylmethyl)pyrimidine-5-carboxamide Openeye Name: N-benzyl-2-[3-(dimethylamino)propylamino]-4-(phenethylamino)pyrimidine-5-carboxamide CAS Name: 2-[3-(dimethylamino)propylamino]-4-(phenethylamino)-N-(phenylmethyl)-5-pyrimidinecarboxamide IUPAC Name: N-benzyl-2-[3-(dimethylamino)propylamino]-4-(phenethylamino)pyrimidine-5-carboxamide Traditional Name: N-benzyl-2-[3-(dimethylamino)propylamino]-4-(phenethylamino)pyrimidine-5-carboxamide Formula: C25H32N6O MolecularWeight: 432.56118

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC1=NC=C(C(=N1)NCCC2=CC=CC=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CN(C)CCCNC1=NC=C(C(=N1)NCCC2=CC=CC=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C25H32N6O/c1-31(2)17-9-15-27-25-29-19-22(24(32)28-18-21-12-7-4-8-13-21)23(30-25)26-16-14-20-10-5-3-6-11-20/h3-8,10-13,19H,9,14-18H2,1-2H3,(H,28,32)(H2,26,27,29,30)