N-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]-2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)ethanamide

Systemtic Name: N-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]-2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)ethanamide Openeye Name: N-[(1,1-dioxothiolan-3-yl)methyl]-2-(4-methyl-1-oxo-phthalazin-2-yl)acetamide CAS Name: N-[(1,1-dioxo-3-thiolanyl)methyl]-2-(4-methyl-1-oxo-2-phthalazinyl)acetamide IUPAC Name: N-[(1,1-dioxothiolan-3-yl)methyl]-2-(4-methyl-1-oxophthalazin-2-yl)acetamide Traditional Name: N-[(1,1-diketothiolan-3-yl)methyl]-2-(1-keto-4-methyl-phthalazin-2-yl)acetamide Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NCC3CCS(=O)(=O)C3

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NCC3CCS(=O)(=O)C3

InChI

InChI=1S/C16H19N3O4S/c1-11-13-4-2-3-5-14(13)16(21)19(18-11)9-15(20)17-8-12-6-7-24(22,23)10-12/h2-5,12H,6-10H2,1H3,(H,17,20)