1-(5-bromanyl-1,3-thiazol-2-yl)-3-[(4-morpholin-4-ylcarbonyl-1-propylsulfonyl-piperidin-4-yl)methyl]urea

Systemtic Name: 1-(5-bromanyl-1,3-thiazol-2-yl)-3-[(4-morpholin-4-ylcarbonyl-1-propylsulfonyl-piperidin-4-yl)methyl]urea Openeye Name: 1-(5-bromothiazol-2-yl)-3-[[4-(morpholine-4-carbonyl)-1-propylsulfonyl-4-piperidyl]methyl]urea CAS Name: 1-(5-bromo-2-thiazolyl)-3-[[4-[4-morpholinyl(oxo)methyl]-1-propylsulfonyl-4-piperidinyl]methyl]urea IUPAC Name: 1-(5-bromo-1,3-thiazol-2-yl)-3-[[4-(morpholine-4-carbonyl)-1-propylsulfonylpiperidin-4-yl]methyl]urea Traditional Name: 1-(5-bromothiazol-2-yl)-3-[[4-(morpholine-4-carbonyl)-1-propylsulfonyl-4-piperidyl]methyl]urea Formula: C18H28BrN5O5S2 MolecularWeight: 538.47942

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC(CC1)(CNC(=O)NC2=NC=C(S2)Br)C(=O)N3CCOCC3

Isomeric SMILES

CCCS(=O)(=O)N1CCC(CC1)(CNC(=O)NC2=NC=C(S2)Br)C(=O)N3CCOCC3

InChI

InChI=1S/C18H28BrN5O5S2/c1-2-11-31(27,28)24-5-3-18(4-6-24,15(25)23-7-9-29-10-8-23)13-21-16(26)22-17-20-12-14(19)30-17/h12H,2-11,13H2,1H3,(H2,20,21,22,26)