6-bromanyl-2-[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-propyl-quinazolin-4-one

Systemtic Name: 6-bromanyl-2-[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-propyl-quinazolin-4-one Openeye Name: 6-bromo-2-[2-(2-ethyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-3-propyl-quinazolin-4-one CAS Name: 6-bromo-2-[[2-(2-ethyl-1-piperidinyl)-2-oxoethyl]thio]-3-propyl-4-quinazolinone IUPAC Name: 6-bromo-2-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl-3-propylquinazolin-4-one Traditional Name: 6-bromo-2-[[2-(2-ethylpiperidino)-2-keto-ethyl]thio]-3-propyl-quinazolin-4-one Formula: C20H26BrN3O2S MolecularWeight: 452.40834

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)N3CCCCC3CC

Isomeric SMILES

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)N3CCCCC3CC

InChI

InChI=1S/C20H26BrN3O2S/c1-3-10-24-19(26)16-12-14(21)8-9-17(16)22-20(24)27-13-18(25)23-11-6-5-7-15(23)4-2/h8-9,12,15H,3-7,10-11,13H2,1-2H3