1-(2-dimethylaminoethyl)-1-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]-3-propan-2-yl-urea

Systemtic Name: 1-(2-dimethylaminoethyl)-1-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]-3-propan-2-yl-urea Openeye Name: 1-(2-dimethylaminoethyl)-3-isopropyl-1-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidyl]urea CAS Name: 1-(2-dimethylaminoethyl)-1-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidinyl]-3-propan-2-ylurea IUPAC Name: 1-(2-dimethylaminoethyl)-1-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]-3-propan-2-ylurea Traditional Name: 1-(2-dimethylaminoethyl)-3-isopropyl-1-[1-(2-mesylbenzyl)-4-piperidyl]urea Formula: C21H36N4O3S MolecularWeight: 424.60054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N(CCN(C)C)C1CCN(CC1)CC2=CC=CC=C2S(=O)(=O)C

Isomeric SMILES

CC(C)NC(=O)N(CCN(C)C)C1CCN(CC1)CC2=CC=CC=C2S(=O)(=O)C

InChI

InChI=1S/C21H36N4O3S/c1-17(2)22-21(26)25(15-14-23(3)4)19-10-12-24(13-11-19)16-18-8-6-7-9-20(18)29(5,27)28/h6-9,17,19H,10-16H2,1-5H3,(H,22,26)