1-tert-butyl-3-[[1-(2-cyanophenyl)sulfonylpiperidin-4-yl]carbonylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[[1-(2-cyanophenyl)sulfonylpiperidin-4-yl]carbonylamino]thiourea Openeye Name: 1-tert-butyl-3-[[1-(2-cyanophenyl)sulfonylpiperidine-4-carbonyl]amino]thiourea CAS Name: 1-tert-butyl-3-[[[1-(2-cyanophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[[1-(2-cyanophenyl)sulfonylpiperidine-4-carbonyl]amino]thiourea Traditional Name: 1-tert-butyl-3-[[1-(2-cyanophenyl)sulfonylisonipecotoyl]amino]thiourea Formula: C18H25N5O3S2 MolecularWeight: 423.5528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N

InChI

InChI=1S/C18H25N5O3S2/c1-18(2,3)20-17(27)22-21-16(24)13-8-10-23(11-9-13)28(25,26)15-7-5-4-6-14(15)12-19/h4-7,13H,8-11H2,1-3H3,(H,21,24)(H2,20,22,27)