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

Systemtic Name: 1-[[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-(4-methoxyphenyl)urea Openeye Name: 1-[[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-(4-methoxyphenyl)urea CAS Name: 1-[[1-(4-chlorophenyl)-2,5-dimethyl-3-pyrrolyl]methyl]-3-(4-methoxyphenyl)urea IUPAC Name: 1-[[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methyl]-3-(4-methoxyphenyl)urea Traditional Name: 1-[[1-(4-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-(4-methoxyphenyl)urea Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)CNC(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)CNC(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22ClN3O2/c1-14-12-16(15(2)25(14)19-8-4-17(22)5-9-19)13-23-21(26)24-18-6-10-20(27-3)11-7-18/h4-12H,13H2,1-3H3,(H2,23,24,26)