N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C19H16N4O2S MolecularWeight: 364.42094

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H16N4O2S/c1-23-19(25)13-7-3-2-6-12(13)17(22-23)18(24)20-11-10-16-21-14-8-4-5-9-15(14)26-16/h2-9H,10-11H2,1H3,(H,20,24)