2-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)sulfanyl]-3-oxidanylidene-N-phenyl-butanamide

Systemtic Name: 2-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)sulfanyl]-3-oxidanylidene-N-phenyl-butanamide Openeye Name: 2-[(4,6-dimorpholino-1,3,5-triazin-2-yl)sulfanyl]-3-oxo-N-phenyl-butanamide CAS Name: 2-[[4,6-bis(4-morpholinyl)-1,3,5-triazin-2-yl]thio]-3-oxo-N-phenylbutanamide IUPAC Name: 2-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)sulfanyl]-3-oxo-N-phenylbutanamide Traditional Name: 2-[(4,6-dimorpholino-s-triazin-2-yl)thio]-3-keto-N-phenyl-butyramide Formula: C21H26N6O4S MolecularWeight: 458.53394

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)NC1=CC=CC=C1)SC2=NC(=NC(=N2)N3CCOCC3)N4CCOCC4

Isomeric SMILES

CC(=O)C(C(=O)NC1=CC=CC=C1)SC2=NC(=NC(=N2)N3CCOCC3)N4CCOCC4

InChI

InChI=1S/C21H26N6O4S/c1-15(28)17(18(29)22-16-5-3-2-4-6-16)32-21-24-19(26-7-11-30-12-8-26)23-20(25-21)27-9-13-31-14-10-27/h2-6,17H,7-14H2,1H3,(H,22,29)