1-[1-[2-(hydroxymethyl)piperidin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]urea

Systemtic Name: 1-[1-[2-(hydroxymethyl)piperidin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]urea Openeye Name: [1-[2-(hydroxymethyl)piperidine-1-carbonyl]-3-methylsulfanyl-propyl]urea CAS Name: [1-[2-(hydroxymethyl)-1-piperidinyl]-4-(methylthio)-1-oxobutan-2-yl]urea IUPAC Name: [1-[2-(hydroxymethyl)piperidin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]urea Traditional Name: [1-(2-methylolpiperidine-1-carbonyl)-3-(methylthio)propyl]urea Formula: C12H23N3O3S MolecularWeight: 289.39432

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCCCC1CO)NC(=O)N

Isomeric SMILES

CSCCC(C(=O)N1CCCCC1CO)NC(=O)N

InChI

InChI=1S/C12H23N3O3S/c1-19-7-5-10(14-12(13)18)11(17)15-6-3-2-4-9(15)8-16/h9-10,16H,2-8H2,1H3,(H3,13,14,18)