3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(thiophen-2-ylmethyl)propanamide

Systemtic Name: 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(thiophen-2-ylmethyl)propanamide Openeye Name: 3-(1,4-dioxo-3H-phthalazin-2-yl)-N-(2-thienylmethyl)propanamide CAS Name: 3-(1,4-dioxo-3H-phthalazin-2-yl)-N-(thiophen-2-ylmethyl)propanamide IUPAC Name: 3-(1,4-dioxo-3H-phthalazin-2-yl)-N-(thiophen-2-ylmethyl)propanamide Traditional Name: 3-(1,4-diketo-3H-phthalazin-2-yl)-N-(2-thenyl)propionamide Formula: C16H15N3O3S MolecularWeight: 329.3736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN(C2=O)CCC(=O)NCC3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN(C2=O)CCC(=O)NCC3=CC=CS3

InChI

InChI=1S/C16H15N3O3S/c20-14(17-10-11-4-3-9-23-11)7-8-19-16(22)13-6-2-1-5-12(13)15(21)18-19/h1-6,9H,7-8,10H2,(H,17,20)(H,18,21)