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

Systemtic Name: 1-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-dimethyl-pyrrol-2-yl]-3-(4-fluorophenyl)urea Openeye Name: 1-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-dimethyl-pyrrol-2-yl]-3-(4-fluorophenyl)urea CAS Name: 1-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-dimethyl-2-pyrrolyl]-3-(4-fluorophenyl)urea IUPAC Name: 1-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-dimethylpyrrol-2-yl]-3-(4-fluorophenyl)urea Traditional Name: 1-(3-cyano-4,5-dimethyl-1-p-anisyl-pyrrol-2-yl)-3-(4-fluorophenyl)urea Formula: C22H21FN4O2 MolecularWeight: 392.426143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)NC2=CC=C(C=C2)F)CC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)NC2=CC=C(C=C2)F)CC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C22H21FN4O2/c1-14-15(2)27(13-16-4-10-19(29-3)11-5-16)21(20(14)12-24)26-22(28)25-18-8-6-17(23)7-9-18/h4-11H,13H2,1-3H3,(H2,25,26,28)