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

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-benzyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-benzyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-benzyl-4-keto-phthalazine-1-carboxamide Formula: C29H20N4O2S MolecularWeight: 488.5597

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=CC=C4C5=NC6=CC=CC=C6S5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=CC=C4C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C29H20N4O2S/c34-27(30-23-15-7-6-14-22(23)28-31-24-16-8-9-17-25(24)36-28)26-20-12-4-5-13-21(20)29(35)33(32-26)18-19-10-2-1-3-11-19/h1-17H,18H2,(H,30,34)