1-[3-[2-[(1-methylsulfonylpiperidin-4-yl)methyl-propyl-amino]propyl]phenyl]urea

Systemtic Name: 1-[3-[2-[(1-methylsulfonylpiperidin-4-yl)methyl-propyl-amino]propyl]phenyl]urea Openeye Name: [3-[2-[(1-methylsulfonyl-4-piperidyl)methyl-propyl-amino]propyl]phenyl]urea CAS Name: [3-[2-[(1-methylsulfonyl-4-piperidinyl)methyl-propylamino]propyl]phenyl]urea IUPAC Name: [3-[2-[(1-methylsulfonylpiperidin-4-yl)methyl-propylamino]propyl]phenyl]urea Traditional Name: [3-[2-[(1-mesyl-4-piperidyl)methyl-propyl-amino]propyl]phenyl]urea Formula: C20H34N4O3S MolecularWeight: 410.57396

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1CCN(CC1)S(=O)(=O)C)C(C)CC2=CC(=CC=C2)NC(=O)N

Isomeric SMILES

CCCN(CC1CCN(CC1)S(=O)(=O)C)C(C)CC2=CC(=CC=C2)NC(=O)N

InChI

InChI=1S/C20H34N4O3S/c1-4-10-23(15-17-8-11-24(12-9-17)28(3,26)27)16(2)13-18-6-5-7-19(14-18)22-20(21)25/h5-7,14,16-17H,4,8-13,15H2,1-3H3,(H3,21,22,25)