2-(3-methylbutylamino)-N-(2-methylpropyl)-4-(phenethylamino)pyrimidine-5-carboxamide

Systemtic Name: 2-(3-methylbutylamino)-N-(2-methylpropyl)-4-(phenethylamino)pyrimidine-5-carboxamide Openeye Name: N-isobutyl-2-(isopentylamino)-4-(phenethylamino)pyrimidine-5-carboxamide CAS Name: 2-(3-methylbutylamino)-N-(2-methylpropyl)-4-(phenethylamino)-5-pyrimidinecarboxamide IUPAC Name: 2-(3-methylbutylamino)-N-(2-methylpropyl)-4-(phenethylamino)pyrimidine-5-carboxamide Traditional Name: 2-(isoamylamino)-N-isobutyl-4-(phenethylamino)pyrimidine-5-carboxamide Formula: C22H33N5O MolecularWeight: 383.53032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC=C(C(=N1)NCCC2=CC=CC=C2)C(=O)NCC(C)C

Isomeric SMILES

CC(C)CCNC1=NC=C(C(=N1)NCCC2=CC=CC=C2)C(=O)NCC(C)C

InChI

InChI=1S/C22H33N5O/c1-16(2)10-12-24-22-26-15-19(21(28)25-14-17(3)4)20(27-22)23-13-11-18-8-6-5-7-9-18/h5-9,15-17H,10-14H2,1-4H3,(H,25,28)(H2,23,24,26,27)