2-chloranyl-1-[2,5-dimethyl-1-(3-methylsulfanylphenyl)pyrrol-3-yl]propan-1-one

Systemtic Name: 2-chloranyl-1-[2,5-dimethyl-1-(3-methylsulfanylphenyl)pyrrol-3-yl]propan-1-one Openeye Name: 2-chloro-1-[2,5-dimethyl-1-(3-methylsulfanylphenyl)pyrrol-3-yl]propan-1-one CAS Name: 2-chloro-1-[2,5-dimethyl-1-[3-(methylthio)phenyl]-3-pyrrolyl]-1-propanone IUPAC Name: 2-chloro-1-[2,5-dimethyl-1-(3-methylsulfanylphenyl)pyrrol-3-yl]propan-1-one Traditional Name: 2-chloro-1-[2,5-dimethyl-1-[3-(methylthio)phenyl]pyrrol-3-yl]propan-1-one Formula: C16H18ClNOS MolecularWeight: 307.83822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)SC)C)C(=O)C(C)Cl

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)SC)C)C(=O)C(C)Cl

InChI

InChI=1S/C16H18ClNOS/c1-10-8-15(16(19)11(2)17)12(3)18(10)13-6-5-7-14(9-13)20-4/h5-9,11H,1-4H3