3-(2-methylpropyl)-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(2-methylpropyl)-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-isobutyl-N-(2-morpholino-1,3-benzothiazol-6-yl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(2-methylpropyl)-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(2-methylpropyl)-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-(2-morpholino-1,3-benzothiazol-6-yl)phthalazine-1-carboxamide Formula: C24H25N5O3S MolecularWeight: 463.552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)N=C(S4)N5CCOCC5

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)N=C(S4)N5CCOCC5

InChI

InChI=1S/C24H25N5O3S/c1-15(2)14-29-23(31)18-6-4-3-5-17(18)21(27-29)22(30)25-16-7-8-19-20(13-16)33-24(26-19)28-9-11-32-12-10-28/h3-8,13,15H,9-12,14H2,1-2H3,(H,25,30)