4-methyl-1-(3-phenylsulfanylindol-1-yl)pentan-2-one

Systemtic Name: 4-methyl-1-(3-phenylsulfanylindol-1-yl)pentan-2-one Openeye Name: 4-methyl-1-(3-phenylsulfanylindol-1-yl)pentan-2-one CAS Name: 4-methyl-1-[3-(phenylthio)-1-indolyl]-2-pentanone IUPAC Name: 4-methyl-1-(3-phenylsulfanylindol-1-yl)pentan-2-one Traditional Name: 4-methyl-1-[3-(phenylthio)indol-1-yl]pentan-2-one Formula: C20H21NOS MolecularWeight: 323.45184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)CN1C=C(C2=CC=CC=C21)SC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(=O)CN1C=C(C2=CC=CC=C21)SC3=CC=CC=C3

InChI

InChI=1S/C20H21NOS/c1-15(2)12-16(22)13-21-14-20(18-10-6-7-11-19(18)21)23-17-8-4-3-5-9-17/h3-11,14-15H,12-13H2,1-2H3