N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-ethyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-ethyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-ethyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-ethyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-ethyl-4-oxophthalazine-1-carboxamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-ethyl-4-keto-phthalazine-1-carboxamide Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC4=C(C=C(C=C4S3)C)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC4=C(C=C(C=C4S3)C)C

InChI

InChI=1S/C20H18N4O2S/c1-4-24-19(26)14-8-6-5-7-13(14)17(23-24)18(25)22-20-21-16-12(3)9-11(2)10-15(16)27-20/h5-10H,4H2,1-3H3,(H,21,22,25)