1-(naphthalen-1-ylmethylsulfanyl)-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 1-(naphthalen-1-ylmethylsulfanyl)-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 4-allyl-1-(1-naphthylmethylsulfanyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 1-(1-naphthalenylmethylthio)-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 1-(naphthalen-1-ylmethylsulfanyl)-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 4-allyl-1-(1-naphthylmethylthio)-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C23H18N4OS MolecularWeight: 398.48022

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C23H18N4OS/c1-2-14-26-21(28)19-12-5-6-13-20(19)27-22(26)24-25-23(27)29-15-17-10-7-9-16-8-3-4-11-18(16)17/h2-13H,1,14-15H2