3-tert-butyl-1-(phenylmethyl)-1-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]urea

Systemtic Name: 3-tert-butyl-1-(phenylmethyl)-1-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]urea Openeye Name: 1-benzyl-1-[3-(4-benzyl-1-piperidyl)propyl]-3-tert-butyl-urea CAS Name: 3-tert-butyl-1-(phenylmethyl)-1-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]urea IUPAC Name: 1-benzyl-1-[3-(4-benzylpiperidin-1-yl)propyl]-3-tert-butylurea Traditional Name: 1-benzyl-1-[3-(4-benzylpiperidino)propyl]-3-tert-butyl-urea Formula: C27H39N3O MolecularWeight: 421.61806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N(CCCN1CCC(CC1)CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)N(CCCN1CCC(CC1)CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C27H39N3O/c1-27(2,3)28-26(31)30(22-25-13-8-5-9-14-25)18-10-17-29-19-15-24(16-20-29)21-23-11-6-4-7-12-23/h4-9,11-14,24H,10,15-22H2,1-3H3,(H,28,31)