1-cyclopentyl-3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonylamino]thiourea

Systemtic Name: 1-cyclopentyl-3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonylamino]thiourea Openeye Name: 1-cyclopentyl-3-[(3,5-ditert-butyl-4-hydroxy-benzoyl)amino]thiourea CAS Name: 1-cyclopentyl-3-[[(3,5-ditert-butyl-4-hydroxyphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-cyclopentyl-3-[(3,5-ditert-butyl-4-hydroxybenzoyl)amino]thiourea Traditional Name: 1-cyclopentyl-3-[(3,5-ditert-butyl-4-hydroxy-benzoyl)amino]thiourea Formula: C21H33N3O2S MolecularWeight: 391.57062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)NNC(=S)NC2CCCC2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)NNC(=S)NC2CCCC2

InChI

InChI=1S/C21H33N3O2S/c1-20(2,3)15-11-13(12-16(17(15)25)21(4,5)6)18(26)23-24-19(27)22-14-9-7-8-10-14/h11-12,14,25H,7-10H2,1-6H3,(H,23,26)(H2,22,24,27)