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

Systemtic Name: N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide Openeye Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propanamide CAS Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide IUPAC Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide Traditional Name: N-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]-3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propionamide Formula: C20H20N6O3S MolecularWeight: 424.4762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN=C2NCCCNC(=O)CCC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN=C2NCCCNC(=O)CCC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C20H20N6O3S/c27-16(8-9-17-23-19(26-29-17)15-7-3-12-30-15)21-10-4-11-22-18-13-5-1-2-6-14(13)20(28)25-24-18/h1-3,5-7,12H,4,8-11H2,(H,21,27)(H,22,24)(H,25,28)