1-[(4-methylphenyl)methyl]-3-(phenylmethyl)-1-[1-(phenylmethyl)pyrrolidin-3-yl]urea

Systemtic Name: 1-[(4-methylphenyl)methyl]-3-(phenylmethyl)-1-[1-(phenylmethyl)pyrrolidin-3-yl]urea Openeye Name: 3-benzyl-1-(1-benzylpyrrolidin-3-yl)-1-(p-tolylmethyl)urea CAS Name: 1-[(4-methylphenyl)methyl]-3-(phenylmethyl)-1-[1-(phenylmethyl)-3-pyrrolidinyl]urea IUPAC Name: 3-benzyl-1-(1-benzylpyrrolidin-3-yl)-1-[(4-methylphenyl)methyl]urea Traditional Name: 3-benzyl-1-(1-benzylpyrrolidin-3-yl)-1-(4-methylbenzyl)urea Formula: C27H31N3O MolecularWeight: 413.55454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2CCN(C2)CC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2CCN(C2)CC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O/c1-22-12-14-25(15-13-22)20-30(27(31)28-18-23-8-4-2-5-9-23)26-16-17-29(21-26)19-24-10-6-3-7-11-24/h2-15,26H,16-21H2,1H3,(H,28,31)