1-[2-[3-(2,3-dimethylcyclohexyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[2-[3-(2,3-dimethylcyclohexyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethyl]pyrrolidine-2,5-dione Openeye Name: 1-[2-[3-(2,3-dimethylcyclohexyl)-4-oxo-quinazolin-2-yl]sulfanylethyl]pyrrolidine-2,5-dione CAS Name: 1-[2-[[3-(2,3-dimethylcyclohexyl)-4-oxo-2-quinazolinyl]thio]ethyl]pyrrolidine-2,5-dione IUPAC Name: 1-[2-[3-(2,3-dimethylcyclohexyl)-4-oxoquinazolin-2-yl]sulfanylethyl]pyrrolidine-2,5-dione Traditional Name: 1-[2-[[3-(2,3-dimethylcyclohexyl)-4-keto-quinazolin-2-yl]thio]ethyl]pyrrolidine-2,5-quinone Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)N2C(=O)C3=CC=CC=C3N=C2SCCN4C(=O)CCC4=O

Isomeric SMILES

CC1CCCC(C1C)N2C(=O)C3=CC=CC=C3N=C2SCCN4C(=O)CCC4=O

InChI

InChI=1S/C22H27N3O3S/c1-14-6-5-9-18(15(14)2)25-21(28)16-7-3-4-8-17(16)23-22(25)29-13-12-24-19(26)10-11-20(24)27/h3-4,7-8,14-15,18H,5-6,9-13H2,1-2H3