1-(4-ethylphenyl)-3-[2-(4-methylpiperidin-1-yl)-5-(4-methylpiperidin-1-yl)sulfonyl-phenyl]urea

Systemtic Name: 1-(4-ethylphenyl)-3-[2-(4-methylpiperidin-1-yl)-5-(4-methylpiperidin-1-yl)sulfonyl-phenyl]urea Openeye Name: 1-(4-ethylphenyl)-3-[2-(4-methyl-1-piperidyl)-5-[(4-methyl-1-piperidyl)sulfonyl]phenyl]urea CAS Name: 1-(4-ethylphenyl)-3-[2-(4-methyl-1-piperidinyl)-5-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]urea IUPAC Name: 1-(4-ethylphenyl)-3-[2-(4-methylpiperidin-1-yl)-5-(4-methylpiperidin-1-yl)sulfonylphenyl]urea Traditional Name: 1-(4-ethylphenyl)-3-[2-(4-methylpiperidino)-5-(4-methylpiperidino)sulfonyl-phenyl]urea Formula: C27H38N4O3S MolecularWeight: 498.68062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCC(CC3)C)N4CCC(CC4)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCC(CC3)C)N4CCC(CC4)C

InChI

InChI=1S/C27H38N4O3S/c1-4-22-5-7-23(8-6-22)28-27(32)29-25-19-24(35(33,34)31-17-13-21(3)14-18-31)9-10-26(25)30-15-11-20(2)12-16-30/h5-10,19-21H,4,11-18H2,1-3H3,(H2,28,29,32)