2-[2-(9H-fluoren-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 2-[2-(9H-fluoren-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 2-[2-(9H-fluoren-3-yl)-2-oxo-ethyl]sulfanyl-3-(3-hydroxypropyl)quinazolin-4-one CAS Name: 2-[[2-(9H-fluoren-3-yl)-2-oxoethyl]thio]-3-(3-hydroxypropyl)-4-quinazolinone IUPAC Name: 2-[2-(9H-fluoren-3-yl)-2-oxoethyl]sulfanyl-3-(3-hydroxypropyl)quinazolin-4-one Traditional Name: 2-[[2-(9H-fluoren-3-yl)-2-keto-ethyl]thio]-3-(3-hydroxypropyl)quinazolin-4-one Formula: C26H22N2O3S MolecularWeight: 442.52948

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3CCCO)C5=CC=CC=C51

Isomeric SMILES

C1C2=C(C=C(C=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3CCCO)C5=CC=CC=C51

InChI

InChI=1S/C26H22N2O3S/c29-13-5-12-28-25(31)21-8-3-4-9-23(21)27-26(28)32-16-24(30)19-11-10-18-14-17-6-1-2-7-20(17)22(18)15-19/h1-4,6-11,15,29H,5,12-14,16H2