[5-methyl-2-methylsulfanyl-1-(phenylmethyl)pyrrol-3-yl]-(4-methylphenyl)methanone

Systemtic Name: [5-methyl-2-methylsulfanyl-1-(phenylmethyl)pyrrol-3-yl]-(4-methylphenyl)methanone Openeye Name: (1-benzyl-5-methyl-2-methylsulfanyl-pyrrol-3-yl)-(p-tolyl)methanone CAS Name: [5-methyl-2-(methylthio)-1-(phenylmethyl)-3-pyrrolyl]-(4-methylphenyl)methanone IUPAC Name: (1-benzyl-5-methyl-2-methylsulfanylpyrrol-3-yl)-(4-methylphenyl)methanone Traditional Name: [1-benzyl-5-methyl-2-(methylthio)pyrrol-3-yl]-(p-tolyl)methanone Formula: C21H21NOS MolecularWeight: 335.46254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(N(C(=C2)C)CC3=CC=CC=C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(N(C(=C2)C)CC3=CC=CC=C3)SC

InChI

InChI=1S/C21H21NOS/c1-15-9-11-18(12-10-15)20(23)19-13-16(2)22(21(19)24-3)14-17-7-5-4-6-8-17/h4-13H,14H2,1-3H3