1-(1-methylsulfonylpiperidin-4-yl)-3-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]urea

Systemtic Name: 1-(1-methylsulfonylpiperidin-4-yl)-3-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]urea Openeye Name: 1-(1-methylsulfonyl-4-piperidyl)-3-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]urea CAS Name: 1-(1-methylsulfonyl-4-piperidinyl)-3-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]urea IUPAC Name: 1-(1-methylsulfonylpiperidin-4-yl)-3-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]urea Traditional Name: 1-(1-mesyl-4-piperidyl)-3-[(6-pyrrolidino-3-pyridyl)methyl]urea Formula: C17H27N5O3S MolecularWeight: 381.49298

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC(=O)NCC2=CN=C(C=C2)N3CCCC3

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC(=O)NCC2=CN=C(C=C2)N3CCCC3

InChI

InChI=1S/C17H27N5O3S/c1-26(24,25)22-10-6-15(7-11-22)20-17(23)19-13-14-4-5-16(18-12-14)21-8-2-3-9-21/h4-5,12,15H,2-3,6-11,13H2,1H3,(H2,19,20,23)