6-bromanyl-2-[1-(3,5-dimethylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-propyl-quinazolin-4-one

Systemtic Name: 6-bromanyl-2-[1-(3,5-dimethylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-propyl-quinazolin-4-one Openeye Name: 6-bromo-2-[2-(3,5-dimethyl-1-piperidyl)-1-methyl-2-oxo-ethyl]sulfanyl-3-propyl-quinazolin-4-one CAS Name: 6-bromo-2-[[1-(3,5-dimethyl-1-piperidinyl)-1-oxopropan-2-yl]thio]-3-propyl-4-quinazolinone IUPAC Name: 6-bromo-2-[1-(3,5-dimethylpiperidin-1-yl)-1-oxopropan-2-yl]sulfanyl-3-propylquinazolin-4-one Traditional Name: 6-bromo-2-[[2-(3,5-dimethylpiperidino)-2-keto-1-methyl-ethyl]thio]-3-propyl-quinazolin-4-one Formula: C21H28BrN3O2S MolecularWeight: 466.43492

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)N3CC(CC(C3)C)C

Isomeric SMILES

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)N3CC(CC(C3)C)C

InChI

InChI=1S/C21H28BrN3O2S/c1-5-8-25-20(27)17-10-16(22)6-7-18(17)23-21(25)28-15(4)19(26)24-11-13(2)9-14(3)12-24/h6-7,10,13-15H,5,8-9,11-12H2,1-4H3