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

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-6-(2-ethylpiperidin-1-yl)sulfonyl-1-methyl-quinazoline-2,4-dione Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-6-[(2-ethyl-1-piperidyl)sulfonyl]-1-methyl-quinazoline-2,4-dione CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-6-[(2-ethyl-1-piperidinyl)sulfonyl]-1-methylquinazoline-2,4-dione IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-6-(2-ethylpiperidin-1-yl)sulfonyl-1-methylquinazoline-2,4-dione Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-6-(2-ethylpiperidino)sulfonyl-1-methyl-quinazoline-2,4-quinone Formula: C24H34N4O5S MolecularWeight: 490.61556

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)CC(=O)N4CCCCCC4)C

Isomeric SMILES

CCC1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)CC(=O)N4CCCCCC4)C

InChI

InChI=1S/C24H34N4O5S/c1-3-18-10-6-9-15-28(18)34(32,33)19-11-12-21-20(16-19)23(30)27(24(31)25(21)2)17-22(29)26-13-7-4-5-8-14-26/h11-12,16,18H,3-10,13-15,17H2,1-2H3