1-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methyl]-3-(3-methylsulfanylphenyl)urea

Systemtic Name: 1-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methyl]-3-(3-methylsulfanylphenyl)urea Openeye Name: 1-[[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]methyl]-3-(3-methylsulfanylphenyl)urea CAS Name: 1-[[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]methyl]-3-[3-(methylthio)phenyl]urea IUPAC Name: 1-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methyl]-3-(3-methylsulfanylphenyl)urea Traditional Name: 1-[[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]methyl]-3-[3-(methylthio)phenyl]urea Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C)CNC(=O)NC3=CC(=CC=C3)SC)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C)CNC(=O)NC3=CC(=CC=C3)SC)C

InChI

InChI=1S/C22H25N3OS/c1-15-8-10-20(11-9-15)25-16(2)12-18(17(25)3)14-23-22(26)24-19-6-5-7-21(13-19)27-4/h5-13H,14H2,1-4H3,(H2,23,24,26)