N-[(2-methoxyphenyl)methyl]-4-oxidanylidene-3-(phenylmethyl)-N-(thiophen-2-ylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-4-oxidanylidene-3-(phenylmethyl)-N-(thiophen-2-ylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[(2-methoxyphenyl)methyl]-4-oxo-N-(2-thienylmethyl)phthalazine-1-carboxamide CAS Name: N-[(2-methoxyphenyl)methyl]-4-oxo-3-(phenylmethyl)-N-(thiophen-2-ylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[(2-methoxyphenyl)methyl]-4-oxo-N-(thiophen-2-ylmethyl)phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-o-anisyl-N-(2-thenyl)phthalazine-1-carboxamide Formula: C29H25N3O3S MolecularWeight: 495.5921

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN(CC2=CC=CS2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1CN(CC2=CC=CS2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C29H25N3O3S/c1-35-26-16-8-5-12-22(26)19-31(20-23-13-9-17-36-23)29(34)27-24-14-6-7-15-25(24)28(33)32(30-27)18-21-10-3-2-4-11-21/h2-17H,18-20H2,1H3