N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4-oxidanylidene-N-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4-oxidanylidene-N-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: N-benzyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4-oxo-N-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: N-benzyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-benzyl-4-keto-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-phthalazine-1-carboxamide Formula: C25H20N4O3S MolecularWeight: 456.5163

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC3=CC=CC=C3)C4=NC5=C(S4)C=C(C=C5)OC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC3=CC=CC=C3)C4=NC5=C(S4)C=C(C=C5)OC

InChI

InChI=1S/C25H20N4O3S/c1-28-23(30)19-11-7-6-10-18(19)22(27-28)24(31)29(15-16-8-4-3-5-9-16)25-26-20-13-12-17(32-2)14-21(20)33-25/h3-14H,15H2,1-2H3