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

Systemtic Name: 3-methyl-2-[(2R)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]sulfanyl-benzo[g]quinazolin-4-one Openeye Name: 3-methyl-2-[(1R)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]sulfanyl-benzo[g]quinazolin-4-one CAS Name: 3-methyl-2-[[(2R)-1-oxo-1-(1-piperidinyl)propan-2-yl]thio]-4-benzo[g]quinazolinone IUPAC Name: 3-methyl-2-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]sulfanylbenzo[g]quinazolin-4-one Traditional Name: 2-[[(1R)-2-keto-1-methyl-2-piperidino-ethyl]thio]-3-methyl-benzo[g]quinazolin-4-one Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1)SC2=NC3=CC4=CC=CC=C4C=C3C(=O)N2C

Isomeric SMILES

C[C@H](C(=O)N1CCCCC1)SC2=NC3=CC4=CC=CC=C4C=C3C(=O)N2C

InChI

InChI=1S/C21H23N3O2S/c1-14(19(25)24-10-6-3-7-11-24)27-21-22-18-13-16-9-5-4-8-15(16)12-17(18)20(26)23(21)2/h4-5,8-9,12-14H,3,6-7,10-11H2,1-2H3/t14-/m1/s1