[2-[5-(2-azanyl-2-oxidanylidene-ethyl)thiophen-2-yl]-2-oxidanylidene-ethyl] 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoate

Systemtic Name: [2-[5-(2-azanyl-2-oxidanylidene-ethyl)thiophen-2-yl]-2-oxidanylidene-ethyl] 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoate Openeye Name: [2-[5-(2-amino-2-oxo-ethyl)-2-thienyl]-2-oxo-ethyl] 2-(3-methyl-4-oxo-phthalazin-1-yl)acetate CAS Name: 2-(3-methyl-4-oxo-1-phthalazinyl)acetic acid [2-[5-(2-amino-2-oxoethyl)-2-thiophenyl]-2-oxoethyl] ester IUPAC Name: [2-[5-(2-amino-2-oxoethyl)thiophen-2-yl]-2-oxoethyl] 2-(3-methyl-4-oxophthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3-methyl-phthalazin-1-yl)acetic acid [2-[5-(2-amino-2-keto-ethyl)-2-thienyl]-2-keto-ethyl] ester Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)OCC(=O)C3=CC=C(S3)CC(=O)N

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)OCC(=O)C3=CC=C(S3)CC(=O)N

InChI

InChI=1S/C19H17N3O5S/c1-22-19(26)13-5-3-2-4-12(13)14(21-22)9-18(25)27-10-15(23)16-7-6-11(28-16)8-17(20)24/h2-7H,8-10H2,1H3,(H2,20,24)