N-benzo[e][1,3]benzothiazol-2-yl-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C21H14N4O2S MolecularWeight: 386.42646

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

InChI

InChI=1S/C21H14N4O2S/c1-25-20(27)15-9-5-4-8-14(15)18(24-25)19(26)23-21-22-17-13-7-3-2-6-12(13)10-11-16(17)28-21/h2-11H,1H3,(H,22,23,26)