3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1-methyl-6-piperidin-1-ylsulfonyl-quinazoline-2,4-dione

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1-methyl-6-piperidin-1-ylsulfonyl-quinazoline-2,4-dione Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-1-methyl-6-(1-piperidylsulfonyl)quinazoline-2,4-dione CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-1-methyl-6-(1-piperidinylsulfonyl)quinazoline-2,4-dione IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-1-methyl-6-piperidin-1-ylsulfonylquinazoline-2,4-dione Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-1-methyl-6-piperidinosulfonyl-quinazoline-2,4-quinone Formula: C22H30N4O5S MolecularWeight: 462.5624

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)C(=O)N(C1=O)CC(=O)N4CCCCCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)C(=O)N(C1=O)CC(=O)N4CCCCCC4

InChI

InChI=1S/C22H30N4O5S/c1-23-19-10-9-17(32(30,31)25-13-7-4-8-14-25)15-18(19)21(28)26(22(23)29)16-20(27)24-11-5-2-3-6-12-24/h9-10,15H,2-8,11-14,16H2,1H3