1-cyclohexyl-3-[[1-[(2,5-dimethylphenyl)methyl]pyrrol-2-yl]methyl]urea

Systemtic Name: 1-cyclohexyl-3-[[1-[(2,5-dimethylphenyl)methyl]pyrrol-2-yl]methyl]urea Openeye Name: 1-cyclohexyl-3-[[1-[(2,5-dimethylphenyl)methyl]pyrrol-2-yl]methyl]urea CAS Name: 1-cyclohexyl-3-[[1-[(2,5-dimethylphenyl)methyl]-2-pyrrolyl]methyl]urea IUPAC Name: 1-cyclohexyl-3-[[1-[(2,5-dimethylphenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 1-cyclohexyl-3-[[1-(2,5-dimethylbenzyl)pyrrol-2-yl]methyl]urea Formula: C21H29N3O MolecularWeight: 339.47446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C=CC=C2CNC(=O)NC3CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C=CC=C2CNC(=O)NC3CCCCC3

InChI

InChI=1S/C21H29N3O/c1-16-10-11-17(2)18(13-16)15-24-12-6-9-20(24)14-22-21(25)23-19-7-4-3-5-8-19/h6,9-13,19H,3-5,7-8,14-15H2,1-2H3,(H2,22,23,25)