1-(3-naphthalen-2-yloxy-2-oxidanyl-propyl)sulfanyl-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 1-(3-naphthalen-2-yloxy-2-oxidanyl-propyl)sulfanyl-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 4-allyl-1-[2-hydroxy-3-(2-naphthyloxy)propyl]sulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 1-[[2-hydroxy-3-(2-naphthalenyloxy)propyl]thio]-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 1-(2-hydroxy-3-naphthalen-2-yloxypropyl)sulfanyl-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 4-allyl-1-[[2-hydroxy-3-(2-naphthoxy)propyl]thio]-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C25H22N4O3S MolecularWeight: 458.53218

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC(COC4=CC5=CC=CC=C5C=C4)O

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC(COC4=CC5=CC=CC=C5C=C4)O

InChI

InChI=1S/C25H22N4O3S/c1-2-13-28-23(31)21-9-5-6-10-22(21)29-24(28)26-27-25(29)33-16-19(30)15-32-20-12-11-17-7-3-4-8-18(17)14-20/h2-12,14,19,30H,1,13,15-16H2