N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-(furan-2-ylmethyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-(furan-2-ylmethyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-N-(2-furylmethyl)-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-(2-furanylmethyl)-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N-(furan-2-ylmethyl)-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-(1,1-diketothiolan-3-yl)-N-(2-furfuryl)-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC3=CC=CO3)C4CCS(=O)(=O)C4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC3=CC=CO3)C4CCS(=O)(=O)C4

InChI

InChI=1S/C21H23N3O5S/c1-2-10-24-20(25)18-8-4-3-7-17(18)19(22-24)21(26)23(13-16-6-5-11-29-16)15-9-12-30(27,28)14-15/h3-8,11,15H,2,9-10,12-14H2,1H3