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

Systemtic Name: 6-bromanyl-2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-propyl-quinazolin-4-one Openeye Name: 6-bromo-2-(2-indolin-1-yl-2-oxo-ethyl)sulfanyl-3-propyl-quinazolin-4-one CAS Name: 6-bromo-2-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-3-propyl-4-quinazolinone IUPAC Name: 6-bromo-2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-3-propylquinazolin-4-one Traditional Name: 6-bromo-2-[(2-indolin-1-yl-2-keto-ethyl)thio]-3-propyl-quinazolin-4-one Formula: C21H20BrN3O2S MolecularWeight: 458.3714

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C21H20BrN3O2S/c1-2-10-25-20(27)16-12-15(22)7-8-17(16)23-21(25)28-13-19(26)24-11-9-14-5-3-4-6-18(14)24/h3-8,12H,2,9-11,13H2,1H3