N-[2-tert-butyl-3-oxidanylidene-5-(pyridin-4-ylmethylamino)pyridazin-4-yl]-N-methylsulfonyl-methanesulfonamide

Systemtic Name: N-[2-tert-butyl-3-oxidanylidene-5-(pyridin-4-ylmethylamino)pyridazin-4-yl]-N-methylsulfonyl-methanesulfonamide Openeye Name: N-[2-tert-butyl-3-oxo-5-(4-pyridylmethylamino)pyridazin-4-yl]-N-methylsulfonyl-methanesulfonamide CAS Name: N-[2-tert-butyl-3-oxo-5-(pyridin-4-ylmethylamino)-4-pyridazinyl]-N-methylsulfonylmethanesulfonamide IUPAC Name: N-[2-tert-butyl-3-oxo-5-(pyridin-4-ylmethylamino)pyridazin-4-yl]-N-methylsulfonylmethanesulfonamide Traditional Name: N-[2-tert-butyl-3-keto-5-(4-pyridylmethylamino)pyridazin-4-yl]-N-mesyl-methanesulfonamide Formula: C16H23N5O5S2 MolecularWeight: 429.51432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(C=N1)NCC2=CC=NC=C2)N(S(=O)(=O)C)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(C=N1)NCC2=CC=NC=C2)N(S(=O)(=O)C)S(=O)(=O)C

InChI

InChI=1S/C16H23N5O5S2/c1-16(2,3)20-15(22)14(21(27(4,23)24)28(5,25)26)13(11-19-20)18-10-12-6-8-17-9-7-12/h6-9,11,18H,10H2,1-5H3