1-[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]-3-[1-(phenylmethyl)piperidin-4-yl]urea

Systemtic Name: 1-[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]-3-[1-(phenylmethyl)piperidin-4-yl]urea Openeye Name: 1-(1-benzyl-4-piperidyl)-3-(2,6-dibromo-4-isopropyl-phenyl)urea CAS Name: 1-(2,6-dibromo-4-propan-2-ylphenyl)-3-[1-(phenylmethyl)-4-piperidinyl]urea IUPAC Name: 1-(1-benzylpiperidin-4-yl)-3-(2,6-dibromo-4-propan-2-ylphenyl)urea Traditional Name: 1-(1-benzyl-4-piperidyl)-3-(2,6-dibromo-4-isopropyl-phenyl)urea Formula: C22H27Br2N3O MolecularWeight: 509.27728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)Br)NC(=O)NC2CCN(CC2)CC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)Br)NC(=O)NC2CCN(CC2)CC3=CC=CC=C3)Br

InChI

InChI=1S/C22H27Br2N3O/c1-15(2)17-12-19(23)21(20(24)13-17)26-22(28)25-18-8-10-27(11-9-18)14-16-6-4-3-5-7-16/h3-7,12-13,15,18H,8-11,14H2,1-2H3,(H2,25,26,28)