1-(2-methoxyethyl)-3-[[(3R)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]carbonylamino]thiourea

Systemtic Name: 1-(2-methoxyethyl)-3-[[(3R)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]carbonylamino]thiourea Openeye Name: 1-(2-methoxyethyl)-3-[[(3R)-1-(p-tolylsulfonyl)piperidine-3-carbonyl]amino]thiourea CAS Name: 1-(2-methoxyethyl)-3-[[[(3R)-1-(4-methylphenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(2-methoxyethyl)-3-[[(3R)-1-(4-methylphenyl)sulfonylpiperidine-3-carbonyl]amino]thiourea Traditional Name: 1-(2-methoxyethyl)-3-[[(3R)-1-tosylnipecotoyl]amino]thiourea Formula: C17H26N4O4S2 MolecularWeight: 414.54274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NNC(=S)NCCOC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)NNC(=S)NCCOC

InChI

InChI=1S/C17H26N4O4S2/c1-13-5-7-15(8-6-13)27(23,24)21-10-3-4-14(12-21)16(22)19-20-17(26)18-9-11-25-2/h5-8,14H,3-4,9-12H2,1-2H3,(H,19,22)(H2,18,20,26)/t14-/m1/s1