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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-ethyl-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-ethyl-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-N-ethyl-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-ethyl-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-N-ethyl-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC)C3CCS(=O)(=O)C3

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC)[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C18H23N3O4S/c1-3-10-21-17(22)15-8-6-5-7-14(15)16(19-21)18(23)20(4-2)13-9-11-26(24,25)12-13/h5-8,13H,3-4,9-12H2,1-2H3/t13-/m0/s1