3-tert-butyl-1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-propyl-urea

Systemtic Name: 3-tert-butyl-1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-propyl-urea Openeye Name: 3-tert-butyl-1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-propyl-urea CAS Name: 3-tert-butyl-1-[[1-[(3-chlorophenyl)methyl]-2-pyrrolyl]methyl]-1-propylurea IUPAC Name: 3-tert-butyl-1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-propylurea Traditional Name: 3-tert-butyl-1-[[1-(3-chlorobenzyl)pyrrol-2-yl]methyl]-1-propyl-urea Formula: C20H28ClN3O MolecularWeight: 361.90882

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CN1CC2=CC(=CC=C2)Cl)C(=O)NC(C)(C)C

Isomeric SMILES

CCCN(CC1=CC=CN1CC2=CC(=CC=C2)Cl)C(=O)NC(C)(C)C

InChI

InChI=1S/C20H28ClN3O/c1-5-11-24(19(25)22-20(2,3)4)15-18-10-7-12-23(18)14-16-8-6-9-17(21)13-16/h6-10,12-13H,5,11,14-15H2,1-4H3,(H,22,25)