6-bromanyl-2-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfanyl-3-pentyl-quinazolin-4-one

Systemtic Name: 6-bromanyl-2-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfanyl-3-pentyl-quinazolin-4-one Openeye Name: 6-bromo-2-(1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-3-pentyl-quinazolin-4-one CAS Name: 6-bromo-2-[[1-oxo-1-(1-pyrrolidinyl)propan-2-yl]thio]-3-pentyl-4-quinazolinone IUPAC Name: 6-bromo-2-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)sulfanyl-3-pentylquinazolin-4-one Traditional Name: 3-amyl-6-bromo-2-[(2-keto-1-methyl-2-pyrrolidino-ethyl)thio]quinazolin-4-one Formula: C20H26BrN3O2S MolecularWeight: 452.40834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)N3CCCC3

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)N3CCCC3

InChI

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