(5-methyl-2-methylsulfanyl-1-propyl-pyrrol-3-yl)-phenyl-methanone

Systemtic Name: (5-methyl-2-methylsulfanyl-1-propyl-pyrrol-3-yl)-phenyl-methanone Openeye Name: (5-methyl-2-methylsulfanyl-1-propyl-pyrrol-3-yl)-phenyl-methanone CAS Name: [5-methyl-2-(methylthio)-1-propyl-3-pyrrolyl]-phenylmethanone IUPAC Name: (5-methyl-2-methylsulfanyl-1-propylpyrrol-3-yl)-phenylmethanone Traditional Name: [5-methyl-2-(methylthio)-1-propyl-pyrrol-3-yl]-phenyl-methanone Formula: C16H19NOS MolecularWeight: 273.39316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1SC)C(=O)C2=CC=CC=C2)C

Isomeric SMILES

CCCN1C(=CC(=C1SC)C(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C16H19NOS/c1-4-10-17-12(2)11-14(16(17)19-3)15(18)13-8-6-5-7-9-13/h5-9,11H,4,10H2,1-3H3