N-[3-[methyl(methylsulfonyl)amino]propyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[3-[methyl(methylsulfonyl)amino]propyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[3-[methyl(methylsulfonyl)amino]propyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[3-[methyl(methylsulfonyl)amino]propyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[3-[methyl(methylsulfonyl)amino]propyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[3-[mesyl(methyl)amino]propyl]-3H-phthalazine-1-carboxamide Formula: C14H18N4O4S MolecularWeight: 338.38212

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=NNC(=O)C2=CC=CC=C21)S(=O)(=O)C

Isomeric SMILES

CN(CCCNC(=O)C1=NNC(=O)C2=CC=CC=C21)S(=O)(=O)C

InChI

InChI=1S/C14H18N4O4S/c1-18(23(2,21)22)9-5-8-15-14(20)12-10-6-3-4-7-11(10)13(19)17-16-12/h3-4,6-7H,5,8-9H2,1-2H3,(H,15,20)(H,17,19)