N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-(1,1-diketothiolan-3-yl)-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCS(=O)(=O)C3

InChI

InChI=1S/C16H19N3O4S/c1-2-8-19-16(21)13-6-4-3-5-12(13)14(18-19)15(20)17-11-7-9-24(22,23)10-11/h3-6,11H,2,7-10H2,1H3,(H,17,20)