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

Systemtic Name: 1-(diphenylmethyl)sulfanyl-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 4-allyl-1-benzhydrylsulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 1-[(diphenylmethyl)thio]-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 1-benzhydrylsulfanyl-4-prop-2-enyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 4-allyl-1-(benzhydrylthio)-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C25H20N4OS MolecularWeight: 424.5175

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H20N4OS/c1-2-17-28-23(30)20-15-9-10-16-21(20)29-24(28)26-27-25(29)31-22(18-11-5-3-6-12-18)19-13-7-4-8-14-19/h2-16,22H,1,17H2