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

Systemtic Name: 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(3,4-dihydro-2H-thiochromen-4-yl)propanamide Openeye Name: 3-(1,4-dioxo-3H-phthalazin-2-yl)-N-thiochroman-4-yl-propanamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide Traditional Name: 3-(1,4-diketo-3H-phthalazin-2-yl)-N-thiochroman-4-yl-propionamide Formula: C20H19N3O3S MolecularWeight: 381.44816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=O)CCN3C(=O)C4=CC=CC=C4C(=O)N3

Isomeric SMILES

C1CSC2=CC=CC=C2C1NC(=O)CCN3C(=O)C4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C20H19N3O3S/c24-18(21-16-10-12-27-17-8-4-3-7-15(16)17)9-11-23-20(26)14-6-2-1-5-13(14)19(25)22-23/h1-8,16H,9-12H2,(H,21,24)(H,22,25)