1-methyl-1-(phenylmethyl)-3-[(2-piperidin-1-ylsulfonylphenyl)methyl]urea

Systemtic Name: 1-methyl-1-(phenylmethyl)-3-[(2-piperidin-1-ylsulfonylphenyl)methyl]urea Openeye Name: 1-benzyl-1-methyl-3-[[2-(1-piperidylsulfonyl)phenyl]methyl]urea CAS Name: 1-methyl-1-(phenylmethyl)-3-[[2-(1-piperidinylsulfonyl)phenyl]methyl]urea IUPAC Name: 1-benzyl-1-methyl-3-[(2-piperidin-1-ylsulfonylphenyl)methyl]urea Traditional Name: 1-benzyl-1-methyl-3-(2-piperidinosulfonylbenzyl)urea Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCCCC3

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H27N3O3S/c1-23(17-18-10-4-2-5-11-18)21(25)22-16-19-12-6-7-13-20(19)28(26,27)24-14-8-3-9-15-24/h2,4-7,10-13H,3,8-9,14-17H2,1H3,(H,22,25)