3-ethyl-1-[(4-methylsulfonylphenyl)methyl]-1-[1-(phenylmethyl)piperidin-4-yl]urea

Systemtic Name: 3-ethyl-1-[(4-methylsulfonylphenyl)methyl]-1-[1-(phenylmethyl)piperidin-4-yl]urea Openeye Name: 1-(1-benzyl-4-piperidyl)-3-ethyl-1-[(4-methylsulfonylphenyl)methyl]urea CAS Name: 3-ethyl-1-[(4-methylsulfonylphenyl)methyl]-1-[1-(phenylmethyl)-4-piperidinyl]urea IUPAC Name: 1-(1-benzylpiperidin-4-yl)-3-ethyl-1-[(4-methylsulfonylphenyl)methyl]urea Traditional Name: 1-(1-benzyl-4-piperidyl)-3-ethyl-1-(4-mesylbenzyl)urea Formula: C23H31N3O3S MolecularWeight: 429.57554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N(CC1=CC=C(C=C1)S(=O)(=O)C)C2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCNC(=O)N(CC1=CC=C(C=C1)S(=O)(=O)C)C2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3S/c1-3-24-23(27)26(18-20-9-11-22(12-10-20)30(2,28)29)21-13-15-25(16-14-21)17-19-7-5-4-6-8-19/h4-12,21H,3,13-18H2,1-2H3,(H,24,27)