1-[(2R)-3-methylbutan-2-yl]-3-(2-methylphenyl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]urea

Systemtic Name: 1-[(2R)-3-methylbutan-2-yl]-3-(2-methylphenyl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Openeye Name: 1-[(1R)-1,2-dimethylpropyl]-1-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]-3-(o-tolyl)urea CAS Name: 1-[(2R)-3-methylbutan-2-yl]-3-(2-methylphenyl)-1-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]urea IUPAC Name: 1-[(2R)-3-methylbutan-2-yl]-3-(2-methylphenyl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 1-[(1R)-1,2-dimethylpropyl]-1-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]-3-(o-tolyl)urea Formula: C26H33N3O MolecularWeight: 403.55972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=CC=C2CN(C(C)C(C)C)C(=O)NC3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=CC=C2CN([C@H](C)C(C)C)C(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C26H33N3O/c1-19(2)22(5)29(26(30)27-25-14-7-6-11-21(25)4)18-24-13-9-15-28(24)17-23-12-8-10-20(3)16-23/h6-16,19,22H,17-18H2,1-5H3,(H,27,30)/t22-/m1/s1