3-ethyl-2-[(2R)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]sulfanyl-benzo[g]quinazolin-4-one

Systemtic Name: 3-ethyl-2-[(2R)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]sulfanyl-benzo[g]quinazolin-4-one Openeye Name: 3-ethyl-2-[(1R)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]sulfanyl-benzo[g]quinazolin-4-one CAS Name: 3-ethyl-2-[[(2R)-1-oxo-1-(1-piperidinyl)propan-2-yl]thio]-4-benzo[g]quinazolinone IUPAC Name: 3-ethyl-2-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]sulfanylbenzo[g]quinazolin-4-one Traditional Name: 3-ethyl-2-[[(1R)-2-keto-1-methyl-2-piperidino-ethyl]thio]benzo[g]quinazolin-4-one Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SC(C)C(=O)N4CCCCC4

Isomeric SMILES

CCN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1S[C@H](C)C(=O)N4CCCCC4

InChI

InChI=1S/C22H25N3O2S/c1-3-25-21(27)18-13-16-9-5-6-10-17(16)14-19(18)23-22(25)28-15(2)20(26)24-11-7-4-8-12-24/h5-6,9-10,13-15H,3-4,7-8,11-12H2,1-2H3/t15-/m1/s1