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

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-ethyl-1-methyl-2,4-bis(oxidanylidene)quinazoline-6-sulfonamide Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-N-ethyl-1-methyl-2,4-dioxo-quinazoline-6-sulfonamide CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-N-ethyl-1-methyl-2,4-dioxo-6-quinazolinesulfonamide IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-N-ethyl-1-methyl-2,4-dioxoquinazoline-6-sulfonamide Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-N-ethyl-2,4-diketo-1-methyl-quinazoline-6-sulfonamide Formula: C19H26N4O5S MolecularWeight: 422.49854

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C1=CC2=C(C=C1)N(C(=O)N(C2=O)CC(=O)N3CCCCCC3)C

Isomeric SMILES

CCNS(=O)(=O)C1=CC2=C(C=C1)N(C(=O)N(C2=O)CC(=O)N3CCCCCC3)C

InChI

InChI=1S/C19H26N4O5S/c1-3-20-29(27,28)14-8-9-16-15(12-14)18(25)23(19(26)21(16)2)13-17(24)22-10-6-4-5-7-11-22/h8-9,12,20H,3-7,10-11,13H2,1-2H3