1-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-3-(3,4-dichlorophenyl)urea

Systemtic Name: 1-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-3-(3,4-dichlorophenyl)urea Openeye Name: 1-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-3-(3,4-dichlorophenyl)urea CAS Name: 1-(3-cyano-1-cyclohexyl-4,5-dimethyl-2-pyrrolyl)-3-(3,4-dichlorophenyl)urea IUPAC Name: 1-(3-cyano-1-cyclohexyl-4,5-dimethylpyrrol-2-yl)-3-(3,4-dichlorophenyl)urea Traditional Name: 1-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-3-(3,4-dichlorophenyl)urea Formula: C20H22Cl2N4O MolecularWeight: 405.32088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)NC2=CC(=C(C=C2)Cl)Cl)C3CCCCC3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)NC2=CC(=C(C=C2)Cl)Cl)C3CCCCC3)C

InChI

InChI=1S/C20H22Cl2N4O/c1-12-13(2)26(15-6-4-3-5-7-15)19(16(12)11-23)25-20(27)24-14-8-9-17(21)18(22)10-14/h8-10,15H,3-7H2,1-2H3,(H2,24,25,27)