4-[4-(4-imidazol-1-yl-6-morpholin-4-yl-1,3,5-triazin-2-yl)piperazin-1-yl]aniline

Systemtic Name: 4-[4-(4-imidazol-1-yl-6-morpholin-4-yl-1,3,5-triazin-2-yl)piperazin-1-yl]aniline Openeye Name: 4-[4-(4-imidazol-1-yl-6-morpholino-1,3,5-triazin-2-yl)piperazin-1-yl]aniline CAS Name: 4-[4-[4-(1-imidazolyl)-6-(4-morpholinyl)-1,3,5-triazin-2-yl]-1-piperazinyl]aniline IUPAC Name: 4-[4-(4-imidazol-1-yl-6-morpholin-4-yl-1,3,5-triazin-2-yl)piperazin-1-yl]aniline Traditional Name: [4-[4-(4-imidazol-1-yl-6-morpholino-s-triazin-2-yl)piperazino]phenyl]amine Formula: C20H25N9O MolecularWeight: 407.4722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)N)C3=NC(=NC(=N3)N4C=CN=C4)N5CCOCC5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)N)C3=NC(=NC(=N3)N4C=CN=C4)N5CCOCC5

InChI

InChI=1S/C20H25N9O/c21-16-1-3-17(4-2-16)26-7-9-27(10-8-26)18-23-19(28-11-13-30-14-12-28)25-20(24-18)29-6-5-22-15-29/h1-6,15H,7-14,21H2