2-(9H-fluoren-9-ylsulfanyl)-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one

Systemtic Name: 2-(9H-fluoren-9-ylsulfanyl)-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Openeye Name: 2-(9H-fluoren-9-ylsulfanyl)-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one CAS Name: 2-(9H-fluoren-9-ylthio)-3-(1H-1,2,4-triazol-5-yl)-4-quinazolinone IUPAC Name: 2-(9H-fluoren-9-ylsulfanyl)-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Traditional Name: 2-(9H-fluoren-9-ylthio)-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Formula: C23H15N5OS MolecularWeight: 409.4631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)SC4=NC5=CC=CC=C5C(=O)N4C6=NC=NN6

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)SC4=NC5=CC=CC=C5C(=O)N4C6=NC=NN6

InChI

InChI=1S/C23H15N5OS/c29-21-18-11-5-6-12-19(18)26-23(28(21)22-24-13-25-27-22)30-20-16-9-3-1-7-14(16)15-8-2-4-10-17(15)20/h1-13,20H,(H,24,25,27)