3-tert-butylsulfanylbenzo[b]phenalen-7-one

Systemtic Name: 3-tert-butylsulfanylbenzo[b]phenalen-7-one Openeye Name: 3-tert-butylsulfanylbenzo[b]phenalen-7-one CAS Name: 3-(tert-butylthio)-7-benzo[b]phenalenone IUPAC Name: 3-tert-butylsulfanylbenzo[b]phenalen-7-one Traditional Name: 3-(tert-butylthio)benzo[b]phenalen-7-one Formula: C21H18OS MolecularWeight: 318.43202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1=C2C=CC=C3C2=C(C=C1)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)(C)SC1=C2C=CC=C3C2=C(C=C1)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H18OS/c1-21(2,3)23-18-12-11-14-13-7-4-5-8-15(13)20(22)17-10-6-9-16(18)19(14)17/h4-12H,1-3H3