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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC=C(S3)CC4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC=C(S3)CC4=CC=CC=C4

InChI

InChI=1S/C23H22N4O2S/c1-2-3-13-27-22(29)19-12-8-7-11-18(19)20(26-27)21(28)25-23-24-15-17(30-23)14-16-9-5-4-6-10-16/h4-12,15H,2-3,13-14H2,1H3,(H,24,25,28)