5-oxidanylidene-N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-5-thiophen-2-yl-pentanamide

Systemtic Name: 5-oxidanylidene-N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-5-thiophen-2-yl-pentanamide Openeye Name: 5-oxo-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-5-(2-thienyl)pentanamide CAS Name: 5-oxo-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-5-thiophen-2-ylpentanamide IUPAC Name: 5-oxo-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-5-thiophen-2-ylpentanamide Traditional Name: 5-keto-N-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]-5-(2-thienyl)valeramide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN=C2NCCCNC(=O)CCCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN=C2NCCCNC(=O)CCCC(=O)C3=CC=CS3

InChI

InChI=1S/C20H22N4O3S/c25-16(17-9-4-13-28-17)8-3-10-18(26)21-11-5-12-22-19-14-6-1-2-7-15(14)20(27)24-23-19/h1-2,4,6-7,9,13H,3,5,8,10-12H2,(H,21,26)(H,22,23)(H,24,27)