1-[3-[[(3R)-3-methyl-4-methylsulfonyl-piperazin-1-yl]methyl]phenyl]-3-(6-methylpyridin-3-yl)urea

Systemtic Name: 1-[3-[[(3R)-3-methyl-4-methylsulfonyl-piperazin-1-yl]methyl]phenyl]-3-(6-methylpyridin-3-yl)urea Openeye Name: 1-[3-[[(3R)-3-methyl-4-methylsulfonyl-piperazin-1-yl]methyl]phenyl]-3-(6-methyl-3-pyridyl)urea CAS Name: 1-[3-[[(3R)-3-methyl-4-methylsulfonyl-1-piperazinyl]methyl]phenyl]-3-(6-methyl-3-pyridinyl)urea IUPAC Name: 1-[3-[[(3R)-3-methyl-4-methylsulfonylpiperazin-1-yl]methyl]phenyl]-3-(6-methylpyridin-3-yl)urea Traditional Name: 1-[3-[[(3R)-4-mesyl-3-methyl-piperazino]methyl]phenyl]-3-(6-methyl-3-pyridyl)urea Formula: C20H27N5O3S MolecularWeight: 417.52508

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C)CC2=CC(=CC=C2)NC(=O)NC3=CN=C(C=C3)C

Isomeric SMILES

C[C@@H]1CN(CCN1S(=O)(=O)C)CC2=CC(=CC=C2)NC(=O)NC3=CN=C(C=C3)C

InChI

InChI=1S/C20H27N5O3S/c1-15-7-8-19(12-21-15)23-20(26)22-18-6-4-5-17(11-18)14-24-9-10-25(16(2)13-24)29(3,27)28/h4-8,11-12,16H,9-10,13-14H2,1-3H3,(H2,22,23,26)/t16-/m1/s1