4-oxidanylidene-3-pentyl-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-pentyl-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]phthalazine-1-carboxamide Openeye Name: 4-oxo-3-pentyl-N-[4-(1-piperidylmethyl)thiazol-2-yl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-pentyl-N-[4-(1-piperidinylmethyl)-2-thiazolyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-pentyl-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]phthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-[4-(piperidinomethyl)thiazol-2-yl]phthalazine-1-carboxamide Formula: C23H29N5O2S MolecularWeight: 439.57366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)CN4CCCCC4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)CN4CCCCC4

InChI

InChI=1S/C23H29N5O2S/c1-2-3-7-14-28-22(30)19-11-6-5-10-18(19)20(26-28)21(29)25-23-24-17(16-31-23)15-27-12-8-4-9-13-27/h5-6,10-11,16H,2-4,7-9,12-15H2,1H3,(H,24,25,29)