6-bromanyl-2-[(2R)-1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-[(2R)-2-oxidanylpropyl]quinazolin-4-one

Systemtic Name: 6-bromanyl-2-[(2R)-1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-[(2R)-2-oxidanylpropyl]quinazolin-4-one Openeye Name: 6-bromo-3-[(2R)-2-hydroxypropyl]-2-[(1R)-2-indolin-1-yl-1-methyl-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 6-bromo-2-[[(2R)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]thio]-3-[(2R)-2-hydroxypropyl]-4-quinazolinone IUPAC Name: 6-bromo-2-[(2R)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]sulfanyl-3-[(2R)-2-hydroxypropyl]quinazolin-4-one Traditional Name: 6-bromo-3-[(2R)-2-hydroxypropyl]-2-[[(1R)-2-indolin-1-yl-2-keto-1-methyl-ethyl]thio]quinazolin-4-one Formula: C22H22BrN3O3S MolecularWeight: 488.39738

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)N3CCC4=CC=CC=C43)O

Isomeric SMILES

C[C@H](CN1C(=O)C2=C(C=CC(=C2)Br)N=C1S[C@H](C)C(=O)N3CCC4=CC=CC=C43)O

InChI

InChI=1S/C22H22BrN3O3S/c1-13(27)12-26-21(29)17-11-16(23)7-8-18(17)24-22(26)30-14(2)20(28)25-10-9-15-5-3-4-6-19(15)25/h3-8,11,13-14,27H,9-10,12H2,1-2H3/t13-,14-/m1/s1