3-(4-chloranyl-2-methyl-phenyl)-1-[(4-methylphenyl)methyl]-1-(2-pyrrolidin-1-ylethyl)urea

Systemtic Name: 3-(4-chloranyl-2-methyl-phenyl)-1-[(4-methylphenyl)methyl]-1-(2-pyrrolidin-1-ylethyl)urea Openeye Name: 3-(4-chloro-2-methyl-phenyl)-1-(p-tolylmethyl)-1-(2-pyrrolidin-1-ylethyl)urea CAS Name: 3-(4-chloro-2-methylphenyl)-1-[(4-methylphenyl)methyl]-1-[2-(1-pyrrolidinyl)ethyl]urea IUPAC Name: 3-(4-chloro-2-methylphenyl)-1-[(4-methylphenyl)methyl]-1-(2-pyrrolidin-1-ylethyl)urea Traditional Name: 3-(4-chloro-2-methyl-phenyl)-1-(4-methylbenzyl)-1-(2-pyrrolidinoethyl)urea Formula: C22H28ClN3O MolecularWeight: 385.93022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCN2CCCC2)C(=O)NC3=C(C=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCN2CCCC2)C(=O)NC3=C(C=C(C=C3)Cl)C

InChI

InChI=1S/C22H28ClN3O/c1-17-5-7-19(8-6-17)16-26(14-13-25-11-3-4-12-25)22(27)24-21-10-9-20(23)15-18(21)2/h5-10,15H,3-4,11-14,16H2,1-2H3,(H,24,27)