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

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1-methyl-N-(4-methylpyridin-2-yl)-2,4-bis(oxidanylidene)quinazoline-6-sulfonamide Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-1-methyl-N-(4-methyl-2-pyridyl)-2,4-dioxo-quinazoline-6-sulfonamide CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-1-methyl-N-(4-methyl-2-pyridinyl)-2,4-dioxo-6-quinazolinesulfonamide IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-1-methyl-N-(4-methylpyridin-2-yl)-2,4-dioxoquinazoline-6-sulfonamide Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-2,4-diketo-1-methyl-N-(4-methyl-2-pyridyl)quinazoline-6-sulfonamide Formula: C23H27N5O5S MolecularWeight: 485.55598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)CC(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=CC(=NC=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)CC(=O)N4CCCCCC4)C

InChI

InChI=1S/C23H27N5O5S/c1-16-9-10-24-20(13-16)25-34(32,33)17-7-8-19-18(14-17)22(30)28(23(31)26(19)2)15-21(29)27-11-5-3-4-6-12-27/h7-10,13-14H,3-6,11-12,15H2,1-2H3,(H,24,25)