3-(3-methylbutyl)-4-oxidanylidene-N-(1,3-thiazol-2-yl)phthalazine-1-carboxamide

Systemtic Name: 3-(3-methylbutyl)-4-oxidanylidene-N-(1,3-thiazol-2-yl)phthalazine-1-carboxamide Openeye Name: 3-isopentyl-4-oxo-N-thiazol-2-yl-phthalazine-1-carboxamide CAS Name: 3-(3-methylbutyl)-4-oxo-N-(2-thiazolyl)-1-phthalazinecarboxamide IUPAC Name: 3-(3-methylbutyl)-4-oxo-N-(1,3-thiazol-2-yl)phthalazine-1-carboxamide Traditional Name: 3-isoamyl-4-keto-N-thiazol-2-yl-phthalazine-1-carboxamide Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC=CS3

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC=CS3

InChI

InChI=1S/C17H18N4O2S/c1-11(2)7-9-21-16(23)13-6-4-3-5-12(13)14(20-21)15(22)19-17-18-8-10-24-17/h3-6,8,10-11H,7,9H2,1-2H3,(H,18,19,22)