N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-4-keto-phthalazine-1-carboxamide Formula: C19H21N5O2S MolecularWeight: 383.46734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NN=C(S3)C4CC4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NN=C(S3)C4CC4

InChI

InChI=1S/C19H21N5O2S/c1-2-3-6-11-24-18(26)14-8-5-4-7-13(14)15(23-24)16(25)20-19-22-21-17(27-19)12-9-10-12/h4-5,7-8,12H,2-3,6,9-11H2,1H3,(H,20,22,25)