1-tert-butyl-3-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]thiourea

Systemtic Name: 1-tert-butyl-3-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]thiourea Openeye Name: 1-tert-butyl-3-[3-[4-(1-piperidylsulfonyl)phenyl]propanoylamino]thiourea CAS Name: 1-tert-butyl-3-[[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propyl]amino]thiourea IUPAC Name: 1-tert-butyl-3-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]thiourea Traditional Name: 1-tert-butyl-3-[3-(4-piperidinosulfonylphenyl)propanoylamino]thiourea Formula: C19H30N4O3S2 MolecularWeight: 426.5965

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NNC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC(C)(C)NC(=S)NNC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C19H30N4O3S2/c1-19(2,3)20-18(27)22-21-17(24)12-9-15-7-10-16(11-8-15)28(25,26)23-13-5-4-6-14-23/h7-8,10-11H,4-6,9,12-14H2,1-3H3,(H,21,24)(H2,20,22,27)