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

Systemtic Name: 3-butyl-N-(5-methyl-1,3-thiazol-2-yl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-(5-methylthiazol-2-yl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-(5-methyl-2-thiazolyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-(5-methyl-1,3-thiazol-2-yl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-4-keto-N-(5-methylthiazol-2-yl)phthalazine-1-carboxamide Formula: C17H18N4O2S MolecularWeight: 342.41542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O2S/c1-3-4-9-21-16(23)13-8-6-5-7-12(13)14(20-21)15(22)19-17-18-10-11(2)24-17/h5-8,10H,3-4,9H2,1-2H3,(H,18,19,22)