3-(2-methylpropyl)-4-oxidanylidene-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]phthalazine-1-carboxamide

Systemtic Name: 3-(2-methylpropyl)-4-oxidanylidene-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]phthalazine-1-carboxamide Openeye Name: N-(5-benzylthiazol-2-yl)-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(2-methylpropyl)-4-oxo-N-[5-(phenylmethyl)-2-thiazolyl]-1-phthalazinecarboxamide IUPAC Name: N-(5-benzyl-1,3-thiazol-2-yl)-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(5-benzylthiazol-2-yl)-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC=C(S3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC=C(S3)CC4=CC=CC=C4

InChI

InChI=1S/C23H22N4O2S/c1-15(2)14-27-22(29)19-11-7-6-10-18(19)20(26-27)21(28)25-23-24-13-17(30-23)12-16-8-4-3-5-9-16/h3-11,13,15H,12,14H2,1-2H3,(H,24,25,28)