2-[(4-morpholin-4-ylphenyl)amino]-4-[(phenylmethyl)amino]pyrimidine-5-carboxamide

Systemtic Name: 2-[(4-morpholin-4-ylphenyl)amino]-4-[(phenylmethyl)amino]pyrimidine-5-carboxamide Openeye Name: 4-(benzylamino)-2-(4-morpholinoanilino)pyrimidine-5-carboxamide CAS Name: 2-[4-(4-morpholinyl)anilino]-4-[(phenylmethyl)amino]-5-pyrimidinecarboxamide IUPAC Name: 4-(benzylamino)-2-(4-morpholin-4-ylanilino)pyrimidine-5-carboxamide Traditional Name: 4-(benzylamino)-2-(4-morpholinoanilino)pyrimidine-5-carboxamide Formula: C22H24N6O2 MolecularWeight: 404.46496

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC3=NC=C(C(=N3)NCC4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC3=NC=C(C(=N3)NCC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C22H24N6O2/c23-20(29)19-15-25-22(27-21(19)24-14-16-4-2-1-3-5-16)26-17-6-8-18(9-7-17)28-10-12-30-13-11-28/h1-9,15H,10-14H2,(H2,23,29)(H2,24,25,26,27)