1-(1-methylsulfonylpiperidin-4-yl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea

Systemtic Name: 1-(1-methylsulfonylpiperidin-4-yl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea Openeye Name: 1-(1-methylsulfonyl-4-piperidyl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea CAS Name: 1-(1-methylsulfonyl-4-piperidinyl)-3-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]urea IUPAC Name: 1-(1-methylsulfonylpiperidin-4-yl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea Traditional Name: 1-(1-mesyl-4-piperidyl)-3-[2-(pyrrolidinomethyl)benzyl]urea Formula: C19H30N4O3S MolecularWeight: 394.5315

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC(=O)NCC2=CC=CC=C2CN3CCCC3

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC(=O)NCC2=CC=CC=C2CN3CCCC3

InChI

InChI=1S/C19H30N4O3S/c1-27(25,26)23-12-8-18(9-13-23)21-19(24)20-14-16-6-2-3-7-17(16)15-22-10-4-5-11-22/h2-3,6-7,18H,4-5,8-15H2,1H3,(H2,20,21,24)