2-[[(3S)-5-bromanyl-2-oxidanylidene-1,3-dihydroindol-3-yl]methyl]-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 2-[[(3S)-5-bromanyl-2-oxidanylidene-1,3-dihydroindol-3-yl]methyl]-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 2-[[(3S)-5-bromo-2-oxo-indolin-3-yl]methyl]-3-(3-hydroxypropyl)quinazolin-4-one CAS Name: 2-[[(3S)-5-bromo-2-oxo-1,3-dihydroindol-3-yl]methyl]-3-(3-hydroxypropyl)-4-quinazolinone IUPAC Name: 2-[[(3S)-5-bromo-2-oxo-1,3-dihydroindol-3-yl]methyl]-3-(3-hydroxypropyl)quinazolin-4-one Traditional Name: 2-[[(3S)-5-bromo-2-keto-indolin-3-yl]methyl]-3-(3-hydroxypropyl)quinazolin-4-one Formula: C20H18BrN3O3 MolecularWeight: 428.27922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)CC3C4=C(C=CC(=C4)Br)NC3=O)CCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)C[C@H]3C4=C(C=CC(=C4)Br)NC3=O)CCCO

InChI

InChI=1S/C20H18BrN3O3/c21-12-6-7-17-14(10-12)15(19(26)23-17)11-18-22-16-5-2-1-4-13(16)20(27)24(18)8-3-9-25/h1-2,4-7,10,15,25H,3,8-9,11H2,(H,23,26)/t15-/m0/s1