N-(1,3-benzothiazol-2-yl)-3-methyl-4-oxidanylidene-N-(oxolan-2-ylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-methyl-4-oxidanylidene-N-(oxolan-2-ylmethyl)phthalazine-1-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-methyl-4-oxo-N-(tetrahydrofuran-2-ylmethyl)phthalazine-1-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-methyl-4-oxo-N-(2-oxolanylmethyl)-1-phthalazinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-methyl-4-oxo-N-(oxolan-2-ylmethyl)phthalazine-1-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-keto-3-methyl-N-(tetrahydrofurfuryl)phthalazine-1-carboxamide Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC3CCCO3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC3CCCO3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H20N4O3S/c1-25-20(27)16-9-3-2-8-15(16)19(24-25)21(28)26(13-14-7-6-12-29-14)22-23-17-10-4-5-11-18(17)30-22/h2-5,8-11,14H,6-7,12-13H2,1H3