4-(4-imidazol-1-yl-6-morpholin-4-yl-1,3,5-triazin-2-yl)-N-(3-methylsulfanylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-(4-imidazol-1-yl-6-morpholin-4-yl-1,3,5-triazin-2-yl)-N-(3-methylsulfanylphenyl)piperazine-1-carboxamide Openeye Name: 4-(4-imidazol-1-yl-6-morpholino-1,3,5-triazin-2-yl)-N-(3-methylsulfanylphenyl)piperazine-1-carboxamide CAS Name: 4-[4-(1-imidazolyl)-6-(4-morpholinyl)-1,3,5-triazin-2-yl]-N-[3-(methylthio)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-imidazol-1-yl-6-morpholin-4-yl-1,3,5-triazin-2-yl)-N-(3-methylsulfanylphenyl)piperazine-1-carboxamide Traditional Name: 4-(4-imidazol-1-yl-6-morpholino-s-triazin-2-yl)-N-[3-(methylthio)phenyl]piperazine-1-carboxamide Formula: C22H27N9O2S MolecularWeight: 481.57388

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=N3)N4C=CN=C4)N5CCOCC5

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=N3)N4C=CN=C4)N5CCOCC5

InChI

InChI=1S/C22H27N9O2S/c1-34-18-4-2-3-17(15-18)24-22(32)30-9-7-28(8-10-30)19-25-20(29-11-13-33-14-12-29)27-21(26-19)31-6-5-23-16-31/h2-6,15-16H,7-14H2,1H3,(H,24,32)