3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-(furan-2-ylmethyl)-1-methyl-2,4-bis(oxidanylidene)quinazoline-6-sulfonamide

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-(furan-2-ylmethyl)-1-methyl-2,4-bis(oxidanylidene)quinazoline-6-sulfonamide Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-N-(2-furylmethyl)-1-methyl-2,4-dioxo-quinazoline-6-sulfonamide CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-N-(2-furanylmethyl)-1-methyl-2,4-dioxo-6-quinazolinesulfonamide IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-N-(furan-2-ylmethyl)-1-methyl-2,4-dioxoquinazoline-6-sulfonamide Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-N-(2-furfuryl)-2,4-diketo-1-methyl-quinazoline-6-sulfonamide Formula: C22H26N4O6S MolecularWeight: 474.53004

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)NCC3=CC=CO3)C(=O)N(C1=O)CC(=O)N4CCCCCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)NCC3=CC=CO3)C(=O)N(C1=O)CC(=O)N4CCCCCC4

InChI

InChI=1S/C22H26N4O6S/c1-24-19-9-8-17(33(30,31)23-14-16-7-6-12-32-16)13-18(19)21(28)26(22(24)29)15-20(27)25-10-4-2-3-5-11-25/h6-9,12-13,23H,2-5,10-11,14-15H2,1H3