2-[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(3-morpholin-4-ylpropyl)quinazolin-4-one

Systemtic Name: 2-[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(3-morpholin-4-ylpropyl)quinazolin-4-one Openeye Name: 2-[(1S)-2-indolin-1-yl-1-methyl-2-oxo-ethyl]sulfanyl-3-(3-morpholinopropyl)quinazolin-4-one CAS Name: 2-[[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]thio]-3-[3-(4-morpholinyl)propyl]-4-quinazolinone IUPAC Name: 2-[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]sulfanyl-3-(3-morpholin-4-ylpropyl)quinazolin-4-one Traditional Name: 2-[[(1S)-2-indolin-1-yl-2-keto-1-methyl-ethyl]thio]-3-(3-morpholinopropyl)quinazolin-4-one Formula: C26H30N4O3S MolecularWeight: 478.6064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)SC3=NC4=CC=CC=C4C(=O)N3CCCN5CCOCC5

Isomeric SMILES

C[C@@H](C(=O)N1CCC2=CC=CC=C21)SC3=NC4=CC=CC=C4C(=O)N3CCCN5CCOCC5

InChI

InChI=1S/C26H30N4O3S/c1-19(24(31)29-14-11-20-7-2-5-10-23(20)29)34-26-27-22-9-4-3-8-21(22)25(32)30(26)13-6-12-28-15-17-33-18-16-28/h2-5,7-10,19H,6,11-18H2,1H3/t19-/m0/s1