1-(phenylmethyl)-1-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea

Systemtic Name: 1-(phenylmethyl)-1-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Openeye Name: 1-benzyl-1-[3-(4-benzyl-1-piperidyl)propyl]-3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]urea CAS Name: 3-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]-1-(phenylmethyl)-1-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]urea IUPAC Name: 1-benzyl-1-[3-(4-benzylpiperidin-1-yl)propyl]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Traditional Name: 1-benzyl-1-[3-(4-benzylpiperidino)propyl]-3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]urea Formula: C35H45N3O MolecularWeight: 523.7513

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)N(CCCN2CCC(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)N(CCCN2CCC(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C35H45N3O/c1-28(2)32-17-11-18-33(26-32)35(3,4)36-34(39)38(27-31-15-9-6-10-16-31)22-12-21-37-23-19-30(20-24-37)25-29-13-7-5-8-14-29/h5-11,13-18,26,30H,1,12,19-25,27H2,2-4H3,(H,36,39)