3-tert-butyl-1-[[1-[(4-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-propan-2-yl-urea

Systemtic Name: 3-tert-butyl-1-[[1-[(4-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-propan-2-yl-urea Openeye Name: 3-tert-butyl-1-isopropyl-1-[[1-(p-tolylmethyl)pyrrol-2-yl]methyl]urea CAS Name: 3-tert-butyl-1-[[1-[(4-methylphenyl)methyl]-2-pyrrolyl]methyl]-1-propan-2-ylurea IUPAC Name: 3-tert-butyl-1-[[1-[(4-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-propan-2-ylurea Traditional Name: 3-tert-butyl-1-isopropyl-1-[[1-(4-methylbenzyl)pyrrol-2-yl]methyl]urea Formula: C21H31N3O MolecularWeight: 341.49034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=CC=C2CN(C(C)C)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=CC=C2CN(C(C)C)C(=O)NC(C)(C)C

InChI

InChI=1S/C21H31N3O/c1-16(2)24(20(25)22-21(4,5)6)15-19-8-7-13-23(19)14-18-11-9-17(3)10-12-18/h7-13,16H,14-15H2,1-6H3,(H,22,25)