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

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1-methyl-N-(3-methylbutyl)-2,4-bis(oxidanylidene)quinazoline-6-sulfonamide Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-N-isopentyl-1-methyl-2,4-dioxo-quinazoline-6-sulfonamide CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-1-methyl-N-(3-methylbutyl)-2,4-dioxo-6-quinazolinesulfonamide IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-1-methyl-N-(3-methylbutyl)-2,4-dioxoquinazoline-6-sulfonamide Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-N-isoamyl-2,4-diketo-1-methyl-quinazoline-6-sulfonamide Formula: C22H32N4O5S MolecularWeight: 464.57828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H32N4O5S/c1-16(2)10-11-23-32(30,31)17-8-9-19-18(14-17)21(28)26(22(29)24(19)3)15-20(27)25-12-6-4-5-7-13-25/h8-9,14,16,23H,4-7,10-13,15H2,1-3H3