1-[[1-(3-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-(3-methylbutyl)urea

Systemtic Name: 1-[[1-(3-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-(3-methylbutyl)urea Openeye Name: 1-[[1-(3-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-isopentyl-urea CAS Name: 1-[[1-(3-chlorophenyl)-2,5-dimethyl-3-pyrrolyl]methyl]-3-(3-methylbutyl)urea IUPAC Name: 1-[[1-(3-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methyl]-3-(3-methylbutyl)urea Traditional Name: 1-[[1-(3-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-isoamyl-urea Formula: C19H26ClN3O MolecularWeight: 347.88224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)Cl)C)CNC(=O)NCCC(C)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)Cl)C)CNC(=O)NCCC(C)C

InChI

InChI=1S/C19H26ClN3O/c1-13(2)8-9-21-19(24)22-12-16-10-14(3)23(15(16)4)18-7-5-6-17(20)11-18/h5-7,10-11,13H,8-9,12H2,1-4H3,(H2,21,22,24)